Basic information
- CAS
111-63-7- Standard SMILES
C=COC(=O)CCCCCCCCCCCCCCCCC- InChIKey
AFSIMBWBBOJPJG-UHFFFAOYSA-N- Molecular formula
- C20H38O2
- Average molar mass
- 310.5 g/mol
- Monoisotopic mass
- 310.28718046
Names & identifiers
- Preferred name
- Vinyl stearate
- IUPAC
- ethenyl octadecanoate
- English name
- VINYL STEARATE
- Molecular formula
- C20H38O2
- Molecular weight
- 310.51
Names & synonyms
Vinyl stearateOctadecanoic acid, ethenyl esterStearic acid, vinyl estervinyl octadecanoateUNII-F6L6TFV7BXF6L6TFV7BXNSC-5641EINECS 203-890-0NSC 20891NSC-20891AI3-23120DTXSID20861736
Show more names
Vinyl Stearate ethenyl octadecanoateSTEARIC ACID VINYL ESTEROctadecanoicacid,ethenylesterVINYL STEARATE, INHIBITOR MEHQ (20PPM)Vinyl Stearate (stabilized with MEHQ)>Stearicacidethylester,stabilizedwithMEHQStearic Acid Vinyl Ester (stabilized with MEHQ)
RefChem:194328DTXCID60810622Stearic acid, vinyl ester (8CI)203-890-0AFSIMBWBBOJPJG-UHFFFAOYSA-N111-63-7ethenyl octadecanoateVinyl stearate (stabilized with MEHQ)
Database identifiers
- CAS
111-63-7- PubChem CID
- 66077
- DTXSID
DTXSID20861736- UNII
- F6L6TFV7BX
- EC Number
- 203-890-0
- Nikkaji
- J10.106K
Properties
Computed structural properties
- XLogP
- 9
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 18
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 248
Experimental & physicochemical properties
Food Contact SubstancesFCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
Physicochemical properties
- Melting point
- 35 · 35-37 °C(lit.)
- Boiling point
- 145 °C · 145 °C(lit.)
- Density
- 0.904 g/mL · 0.904 g/mL at 25 °C(lit.)
- refractive index
- 1.4423 · 1.4423 (30/D)
- Flash point
- 230 °F · >230 °F
- storage temp.
- 2 · 2-8°C
- Water Solubility
- Insoluble in water
- form
- powder to lump to clear liquid
- color
- White or Colorless to Light yellow
- Specific Gravity
- 0.904 · 0.904
- Stability
- Stable. Incompatible with acids, bases, strong oxidizing agents.
- InChI
- 1S/C20H38O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-4-2/h4H,2-3,5-19H2,1H3
- InChIKey
- AFSIMBWBBOJPJG-UHFFFAOYSA-N
- SMILES
- CCCCCCCCCCCCCCCCCC(=O)OC=C
- LogP
- 8.781 · 8.781 (est)
- CAS DataBase Reference
- 111 · 111-63-7(CAS DataBase Reference)
- Indirect Additives used in Food Contact Substances
- VINYL STEARATE
- FDA 21 CFR
- 175.105 · 175.105; 176.170; 176.180;177.1210
- FDA UNII
- 6 L6TFV7BX · F6L6TFV7BX
- EPA Substance Registry System
- Octadecanoic acid, ethenyl ester (111-63-7)
- UNSPSC Code
- 12162002 · 12162002
- NACRES
- 23 · NA.23
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
- PPE
- 95 · Eyeshields, Gloves, type N95 (US)
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- WGK Germany
- 3 · 3
- TSCA
- TSCA listed
- HS Code
- 2915.7 · 2915.70.0150
- Storage Class
- 11 · 11 - Combustible Solids
Safety & regulation
Hazard information
Regulatory InformationChemical: Octadecanoic acid, ethenyl ester
Safety data
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 2915.70.0150
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 26-36
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationOctadecanoic acid, ethenyl ester: ACTIVE
Applications
UsesPlasticizer (copolymerizer), lubricant.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers60 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海赛可锐生物科技有限公司021-58000709 13120558703 · [email protected]
上海弘顺生物科技有限公司15901914505 · [email protected]
Syntechem Co.,Ltd[email protected]
上海颖心实验室设备有限公司021-59178156 17002132182 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
广东方信生物科技有限公司0751-2838688 13376594225 · [email protected]
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天津希恩思生化科技有限公司400 638 7771 · [email protected]
ZHEJIANG JIUZHOU CHEM CO., LTD+86-0576225566889 +86-13454675544 · [email protected]；[email protected]；[email protected]
湖南汇百侍生物科技有限公司0731-85526065 13308475853 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
青岛海智微元生物科技有限公司18317699790 18317699790 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
天津荣燊化工有限公司18317763565; 18317763565 · [email protected]
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Alfa Chemistry+1-5166625404 · [email protected]
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Shanghai Acmec Biochemical Technology Co., Ltd.+86-18621343501 · [email protected]
山东百哲新材料有限公司13346272003 · [email protected]
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
上海臻励生物科技有限公司021-16621358918; 18516310516;16621358918;13045646768 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
上海启乔生物科技有限公司021-37653318 15221675714 · [email protected]
上海易恩化学技术有限公司400-400-1332688 18019345275 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
天津希恩思生化科技有限公司400-6387771-6039 18920764717 · [email protected]
TCI Chemicals (India) Pvt. Ltd.[email protected]
SHANDONG ZHI SHANG CHEMICAL CO.LTD0531-68652808 18953170293 · [email protected]
湖北摆渡化学有限公司027-59106051 13627137652 · [email protected]
Related reactions
5 records
Compound notes
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