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1166-52-5

Basic Information
CAS No.: 1166-52-5
Name: Benzoic acid,3,4,5-trihydroxy-, dodecyl ester
Molecular Structure:
Molecular Structure of 1166-52-5 (Benzoic acid,3,4,5-trihydroxy-, dodecyl ester)
Formula: C19H30O5
Molecular Weight: 338.44
Synonyms: Gallicacid, dodecyl ester (6CI,8CI);Dodecyl 3,4,5-trihydroxybenzoate;Dodecylgallate;E 312;Gallic acid lauryl ester;Lauryl 3,4,5-trihydroxybenzoate;Lauryl gallate;NSC 133463;Nipagallin LA;Progallin LA;benzoic acid, 3,4,5-trihydroxy-, dodecyl ester;dodecyl 3,4,5-trihydroxybenzoate;Gallic acid, dodecyl ester (8CI);Lauryl Gallate;n-Dodecyl gallate;
EINECS: 214-620-6
Density: 1.112 g/cm3
Melting Point: 94-97 °C(lit.)
Boiling Point: 521.7 °C at 760 mmHg
Flash Point: 180.3 °C
Solubility: insoluble in water
Appearance: white to cream powder
Hazard Symbols: IrritantXi
Risk Codes: 43
Safety: 24-37
Transport Information:
PSA: 86.99000
LogP: 4.88110
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  • Lauryl gallate

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    1166-52-5

    Lauryl gallate

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  • Dodecyl Gallate

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    1166-52-5

    Dodecyl Gallate

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    Hangzhou Huarong Pharm Co., Ltd.established since 2006 , has been actively developing specialty products for Finished Dosages, APIs, Intermediates, and Fine chemicals markets in North America, Europe, Korea, Japan, Mid-East and all over the World. Hu

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    1166-52-5

    SAGECHEM/Lauryl Gallate

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  • Dodecyl gallate

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    1166-52-5

    Dodecyl gallate

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  • Dodecyl gallate

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    1166-52-5

    Dodecyl gallate

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    Kono Chem Co.,Ltd is a leading producer of standardized herbal extracts, natural active ingredients and APIs for pharmaceutical, health food and cosmetic industries. Annually, mo

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  • Gallic acid n-dodecyl ester

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    1166-52-5

    Gallic acid n-dodecyl ester

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    high purity,in stock Package:25kg/drum,or as per customers'demand Application:API,or Intermediates,fine chemicals Transportation:air,sea,courier

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    Address:Huacai International Building,Sandun,Westlake District,Hangzhou 310030,Zhejiang,China

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  • Benzoic acid,3,4,5-trihydroxy-, dodecyl ester

  • Casno:

    1166-52-5

    Benzoic acid,3,4,5-trihydroxy-, dodecyl ester

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    FOB Price:  USD $ 0.0-0.0/

    R & D enterprises have their own stock in stock Package:1kg Application:pharmaceutical intermediates

    Hangzhou Dingyan Chem Co., LTD. is located in the beautiful tourist city of hangzhou, is a comprehensive chemical enterprice which doing import and export business by its own comp

  •  Hangzhou Dingyan Chem Co., Ltd

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    Business Type:Manufacturers

    Tel:86-571-86465881,86-571-87157530,86-571-88025800

    Address:RM.1118,NO.1 Building, Baiyun Tower,Jianggan Area, Hangzhou city, China,310004

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Reported in EPA TSCA Inventory.

Specification

The Dodecyl gallate, with the CAS registry number 1166-52-5 and EINECS registry number 214-620-6, has the systematic name of dodecyl 3,4,5-trihydroxybenzoate. It is the ester of dodecanol and gallic acid, and the molecular formula is C19H30O5. It is a kind of white to cream powder, and belongs to the product category of Aromatic Esters. It is an air sensitive chemcial, and should be stored at 0-6 °C.

The physical properties of Dodecyl gallate are as following: (1)ACD/LogP: 7.38; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7.38; (4)ACD/LogD (pH 7.4): 7.24; (5)ACD/BCF (pH 5.5): 238775.5; (6)ACD/BCF (pH 7.4): 173417.66; (7)ACD/KOC (pH 5.5): 245779.61; (8)ACD/KOC (pH 7.4): 178504.59; (9)#H bond acceptors: 5; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 16; (12)Polar Surface Area: 53.99 Å2; (13)Index of Refraction: 1.534; (14)Molar Refractivity: 94.63 cm3; (15)Molar Volume: 304.1 cm3; (16)Polarizability: 37.51×10-24cm3; (17)Surface Tension: 46.6 dyne/cm; (18)Density: 1.112 g/cm3; (19)Flash Point: 180.3 °C; (20)Enthalpy of Vaporization: 82.5 kJ/mol; (21)Boiling Point: 521.7 °C at 760 mmHg; (22)Vapour Pressure: 1.67E-11 mmHg at 25°C.

Preparation and uses of Dodecyl gallate: It can be prepared by the esterification of laurinol and ellagic acid. And it is usually used as food additive, antioxidant and preservative.

You should be cautious while dealing with this chemical. It may cause sensitization by skin contact. Therefore, you had better take the following instructions: Avoid contact with skin, and wear suitable gloves.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCCCCCCCCCCCC)c1cc(O)c(O)c(O)c1
(2)InChI: InChI=1/C19H30O5/c1-2-3-4-5-6-7-8-9-10-11-12-24-19(23)15-13-16(20)18(22)17(21)14-15/h13-14,20-22H,2-12H2,1H3
(3)InChIKey: RPWFJAMTCNSJKK-UHFFFAOYAC

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
pig LD50 oral > 6gm/kg (6000mg/kg) KIDNEY, URETER, AND BLADDER: OTHER CHANGES Voeding. Vol. 16, Pg. 683, 1955.
rat LD50 intraperitoneal 100mg/kg (100mg/kg)   FAO Nutrition Meetings Report Series. Vol. 38A, Pg. 22, 1965.
rat LD50 oral 5gm/kg (5000mg/kg) KIDNEY, URETER, AND BLADDER: OTHER CHANGES Voeding. Vol. 16, Pg. 683, 1955.