Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

Pentanedioic acid,3-methyl-,monoethyl ester,(3R)-(9CI)

Related Products

Hot Products

Basic Information Post buying leads Suppliers
Name

Pentanedioic acid,3-methyl-,monoethyl ester,(3R)-(9CI)

EINECS N/A
CAS No. 72594-19-5 Density 1.095 g/cm3
PSA 63.60000 LogP 1.05040
Solubility N/A Melting Point N/A
Formula C8H14O4 Boiling Point 286.755 °C at 760 mmHg
Molecular Weight 174.197 Flash Point 111.346 °C
Transport Information N/A Appearance N/A
Safety 23-24/25 Risk Codes N/A
Molecular Structure Molecular Structure of 72594-19-5 ((R)-1-ETHYL HYDROGEN 3-METHYLGLUTARATE) Hazard Symbols N/A
Synonyms

Pentanedioicacid, 3-methyl-, monoethyl ester, (R)-;Ethyl hydrogen (R)-3-methylglutarate;(3R)-5-ethoxy-3-methyl-5-oxopentanoic acid;

 

Pentanedioic acid,3-methyl-,monoethyl ester,(3R)-(9CI) Specification

The CAS registry number of Pentanedioic acid,3-methyl-, monoethyl ester,(3R)-(9Cl) is 72594-19-5. The systematic name is (3R)-5-ethoxy-3-methyl-5-oxopentanoic acid. In addition, the molecular formula is C8H14O4 and the molecular weight is 174.19. During using it, you should not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer). And you should avoid contact with skin and eyes.

Physical properties about this chemical are: (1)ACD/LogP: 0.91; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0; (4)ACD/LogD (pH 7.4): -2; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 11; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 63.6 Å2; (13)Index of Refraction: 1.446; (14)Molar Refractivity: 42.41 cm3; (15)Molar Volume: 159.074 cm3; (16)Polarizability: 16.813 ×10-24cm3; (17)Surface Tension: 37.766 dyne/cm; (18)Density: 1.095 g/cm3; (19)Flash Point: 111.346 °C; (20)Enthalpy of Vaporization: 57.863 kJ/mol; (21)Boiling Point: 286.755 °C at 760 mmHg; (22)Vapour Pressure: 0.001 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)C[C@H](CC(=O)OCC)C
(2)InChI: InChI=1/C8H14O4/c1-3-12-8(11)5-6(2)4-7(9)10/h6H,3-5H2,1-2H3,(H,9,10)/t6-/m1/s1
(3)InChIKey: KAOCDZQOVPLMID-ZCFIWIBFBO

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 72594-19-5