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139-44-6

Basic Information
CAS No.: 139-44-6
Name: 1,2,3-propanetriyl tris(12-hydroxyoctadecanoate)
Molecular Structure:
Molecular Structure of 139-44-6 (1,2,3-propanetriyl tris(12-hydroxyoctadecanoate))
Formula: C57H110O9
Molecular Weight: 939.495
Synonyms: Octadecanoicacid, 12-hydroxy-, 1,2,3-propanetriyl ester (8CI,9CI);Octadecanoic acid,12-hydroxy-, triester with glycerol (6CI,7CI);Glycerol,tris(12-hydroxyoctadecanoate) (8CI);12-Hydroxystearic acid triglyceride;Glycerol tris(12-hydroxystearate);Glyceryltris(12-hydroxystearate);Octadecanoic acid,12-hydroxy-, 1,1',1''-(1,2,3-propanetriyl) ester;NSC 2389;Tri-12-hydroxystearin;Trihydroxystearin;
EINECS: 205-364-6
Density: 0.964 g/cm3
Melting Point: 89.4 °C
Boiling Point: 872.4 °C at 760 mmHg
Flash Point: 220.1 °C
PSA: 139.59000
LogP: 15.68150
Synthetic route
15505-14-3

castor oil

139-44-6

glyseryl-tris(12-hydroxystearate)

Conditions
ConditionsYield
durch Reduktion;
castor oil

castor oil

139-44-6

glyseryl-tris(12-hydroxystearate)

Conditions
ConditionsYield
With nickel Hydrogenation;
139-44-6

glyseryl-tris(12-hydroxystearate)

1,2,3-tris-(12-oxo-octadecanoyloxy)-propane

Conditions
ConditionsYield
With nickel kieselguhr at 185 - 275℃;
139-44-6

glyseryl-tris(12-hydroxystearate)

nickel kieselguhr

nickel kieselguhr

glycerol-tris-<12-oxo stearate >

glycerol-tris-<12-oxo stearate >

Conditions
ConditionsYield
at 185 - 275℃;
139-44-6

glyseryl-tris(12-hydroxystearate)

4098-71-9

isophorone diisocyanate

polymer, product of polymerization of hydrogenated castor oil and isophorone diisocyanate

polymer, product of polymerization of hydrogenated castor oil and isophorone diisocyanate

Conditions
ConditionsYield
With dibutyltin(II) dilaurate; triethanolamine In xylene at 80 - 120℃; for 30h;
139-44-6

glyseryl-tris(12-hydroxystearate)

4098-71-9

isophorone diisocyanate

polymer, product of radical polymerization of polyurethane and butyl methacrylate; NCO/OH ratio: 2.0; composition (wt percent): polyurethane/poly(butyl methacrylate) = 75/25; tensile strength = 2.8 MPa

polymer, product of radical polymerization of polyurethane and butyl methacrylate; NCO/OH ratio: 2.0; composition (wt percent): polyurethane/poly(butyl methacrylate) = 75/25; tensile strength = 2.8 MPa

Conditions
ConditionsYield
With dibutyltin(II) dilaurate; triethanolamine In xylene at 80 - 120℃; for 30h;
139-44-6

glyseryl-tris(12-hydroxystearate)

4098-71-9

isophorone diisocyanate

polymer, product of radical polymerization of polyurethane and butyl methacrylate; NCO/OH ratio: 2.2; composition (wt percent): polyurethane/poly(butyl methacrylate) = 25/75; tensile strength = 1.4 MPa

polymer, product of radical polymerization of polyurethane and butyl methacrylate; NCO/OH ratio: 2.2; composition (wt percent): polyurethane/poly(butyl methacrylate) = 25/75; tensile strength = 1.4 MPa

Conditions
ConditionsYield
With dibutyltin(II) dilaurate; triethanolamine In xylene at 80 - 120℃; for 30h;
139-44-6

glyseryl-tris(12-hydroxystearate)

4098-71-9

isophorone diisocyanate

polymer, product of radical polymerization of polyurethane and butyl methacrylate; NCO/OH ratio: 2.2; composition (wt percent): polyurethane/poly(butyl methacrylate) = 50/50; tensile strength = 2.5 MPa

polymer, product of radical polymerization of polyurethane and butyl methacrylate; NCO/OH ratio: 2.2; composition (wt percent): polyurethane/poly(butyl methacrylate) = 50/50; tensile strength = 2.5 MPa

Conditions
ConditionsYield
With dibutyltin(II) dilaurate; triethanolamine In xylene at 80 - 120℃; for 30h;
139-44-6

glyseryl-tris(12-hydroxystearate)

4098-71-9

isophorone diisocyanate

polymer, product of radical polymerization of polyurethane and butyl methacrylate; NCO/OH ratio: 2.2; composition (wt percent): polyurethane/poly(butyl methacrylate) = 75/25; tensile strength = 3.6 MPa

polymer, product of radical polymerization of polyurethane and butyl methacrylate; NCO/OH ratio: 2.2; composition (wt percent): polyurethane/poly(butyl methacrylate) = 75/25; tensile strength = 3.6 MPa

Conditions
ConditionsYield
With dibutyltin(II) dilaurate; triethanolamine In xylene at 80 - 120℃; for 30h;
4530-20-5

BOC-glycine

139-44-6

glyseryl-tris(12-hydroxystearate)

C78H143N3O18

Conditions
ConditionsYield
With dmap; dicyclohexyl-carbodiimide In dichloromethane at 45℃; for 48h; Darkness;
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    Product details ProName: Glyceryl tris(12-hydroxystearate) CasNo: 139-44-6 Molecular Formula: C57H110O9 Appearance: brown powder Application: Pharmaceutical Intermediates / Active .. DeliveryTime: within 2-3 days after pa

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  • 1,2,3-propanetriyl tris(12-hydroxyoctadecanoate)

  • Casno:

    139-44-6

    1,2,3-propanetriyl tris(12-hydroxyoctadecanoate)

    Min.Order: 1 Gram

    FOB Price:  USD $ 0.0-0.0

    Hangzhou KieRaychem Co.,Ltd.is located in Yuhang District of Hangzhou City and specialized in the chemical product customization, development, sales, import and export. Current business is focused on fine chemicals, pharmaceutical materials and int

    Hangzhou KieRaychem Co.,Ltd.is located in Yuhang District of Hangzhou City and specialized in the chemical product customization, development, sales, import and export. Current bus

  • Hangzhou KieRay Chem Co.,Ltd.

     China (Mainland)  |  Contact Details

    Business Type:Lab/Research institutions

    Tel:+86-0571-56123425

    Address:Room 260, Building 3, No. 76 Xingqiao North Road, Xingqiao Street, Yuhang District, Hangzhou City, Zhejiang Province, China

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  • 1,2,3-propanetriyl tris(12-hydroxyoctadecanoate)

  • Casno:

    139-44-6

    1,2,3-propanetriyl tris(12-hydroxyoctadecanoate)

    Min.Order: 0 Metric Ton

    FOB Price:  USD $ 0.0-0.0

    food additives Hangzhou Haiqiang Chem Co.Limited is a leading manufacturer and supplier of chemicals in China.We develop,produce and distribute high quality pharmaceuticals, intermediates, special chemicals and other fine chemicals. We

    Hangzhou Haiqiang Chemical Co.,Ltd.is the fully-owned subsidiary of international chemical group HQC GROUP.Our company specialize in the research, development, manufacturing and m

  • Hangzhou Haiqiang Chemical Co.,Ltd.

     China (Mainland)  |  Contact Details

    Business Type:Other

    Tel:+86-571-86050367,+86-571-86050387,+86-571-86050390

    Address:Add: 5/F, Around Town North Road,No. 10, Hangzhou, Zhejiang,China

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  • 1,2,3-propanetriyl tris(12-hydroxyoctadecanoate)

  • Casno:

    139-44-6

    1,2,3-propanetriyl tris(12-hydroxyoctadecanoate)

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    Shanghai, Run-Biotech Co., Ltd is a leading domestic pharmaceutical, biopharmaceutical, and health care products R & D outsourcing services company. As an innovation-driven and customer-focused company, Run Biotech provides a broad and integrated por

    Shanghai fine pharma co., Ltd. is a professional enterprise with chemical reagents and fine chemical products development, development and trade. The company has a sound research a

  • Shanghai Run-Biotech Co., Ltd.

     China (Mainland)  |  Contact Details

    Business Type:Trading Company

    Tel:+86-21-31576854/57171705 / 57171706

    Address:second floor, building 3, No.999, jiangyue Road, minghang District, Shanghai, China

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  • Glyceryl tris(12-hydroxystearate)

  • Casno:

    139-44-6

    Glyceryl tris(12-hydroxystearate)

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    Glyceryl tris(12-hydroxystearate) Storage:keep in dry and cool condition Package:25kg or according to cutomer's demand Application:Chemical research/pharma intermediate Transportation:By Sea,by Air,By courier like DHL or Fedx. Port:Shanghai/Shenzhen

    Nanjing Raymon Biotech Co., Ltd. is specialized in developing and marketing middle & high level pharmaceutical intermediates. We are supplying different categories of high-quality

  • Nanjing Raymon Biotech Co., Ltd.

     China (Mainland)  |  Contact Details

    Business Type:Trading Company

    Tel:86-025-52181296

    Address:Block B, No. 918, Shuanglong Avenue

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  • CSR160805-26782

  • Casno:

    139-44-6

    CSR160805-26782

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    Purity, Prompt shipment, Price Application:surface active agent

    Skyrun Industrial Co.Limited (CSR Ind), established in 2003, a state-controlled company(By Skyrun Corp. & High Hope) in China, specializing in developing, producing and handing ra

  • Skyrun Industrial Co.,Ltd

    China (Mainland)  |  Contact Details

    Business Type:Lab/Research institutions

    Tel:0086-576-84610586

    Address:Chemical Development Zone

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  • Glyceryl tris(12-hydroxystearate)

  • Casno:

    139-44-6

    Glyceryl tris(12-hydroxystearate)

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    Glyceryl tris(12-hydroxystearate)Appearance:Off white to slight yellow solid Storage:Stored in shaded, cool and dry places Package:1L 5L 10L 25L bottle Application:pharma intermediate Transportation:Handle with cares to avoid damaging the packages. P

  • Chemical Co.Ltd

    China (Mainland)  |  Contact Details

    Business Type:Trading Company

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Specification

The Glyceryl tris(12-hydroxystearate), with the CAS registry number 139-44-6, is also known as Propane-1, 2, 3-triyl tris(12-hydroxyoctadecanoatato). Its EINECS registry number is 205-364-6. This chemical's molecular formula is C57H110O9 and molecular weight is 939.4779. What's more, its IUPAC name is 2, 3-Bis(12-hydroxyoctadecanoyloxy)propyl 12-hydroxyoctadecanoate.

Physical properties about Glyceryl tris(12-hydroxystearate) are: (1)ACD/LogP: 18.70; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 18.7; (4)ACD/LogD (pH 7.4): 18.7; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 10000000; (8)ACD/KOC (pH 7.4): 10000000; (9)#H bond acceptors: 9; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 59; (12)Polar Surface Area: 106.59 Å2; (13)Index of Refraction: 1.478; (14)Molar Refractivity: 275.88 cm3; (15)Molar Volume: 973.8 cm3; (16)Polarizability: 109.36×10-24 cm3; (17)Surface Tension: 37.7 dyne/cm; (18)Density: 0.964 g/cm3; (19)Flash Point: 220.1 °C; (20)Enthalpy of Vaporization: 144.06 kJ/mol; (21)Boiling Point: 872.4 °C at 760 mmHg; (22)Vapour Pressure: 1.51E-35 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(OCC(OC(=O)CCCCCCCCCCC(O)CCCCCC)COC(=O)CCCCCCCCCCC(O)CCCCCC)CCCCCCCCCCC(O)CCCCCC
(2) InChI: InChI=1/C57H110O9/c1-4-7-10-31-40-51(58)43-34-25-19-13-16-22-28-37-46-55(61)64-49-54(66-57(63)48-39-30-24-18-15-21-27-36-45-53(60)42-33-12-9-6-3)50-65-56(62)47-38-29-23-17-14-20-26-35-44-52(59)41-32-11-8-5-2/h51-54,58-60H,4-50H2,1-3H3
(3) InChIKey: WCOXQTXVACYMLM-UHFFFAOYAI