Basic information
- CAS
6280-03-1- Standard SMILES
C=COC(=O)CCCCCCCC- InChIKey
NWJTZFZQVYJIHU-UHFFFAOYSA-N- Molecular formula
- C11H20O2
- Average molar mass
- 184.27 g/mol
- Monoisotopic mass
- 184.14632988
Names & identifiers
- Preferred name
- Vinyl pelargonate
- IUPAC
- ethenyl nonanoate
- English name
- VINYL PELARGONATE
- Molecular formula
- C11H20O2
- Molecular weight
- 184.28
Names & synonyms
VINYL PELARGONATEvinyl nonanoate6280-03-1Vinyl nonan-1-oateNSC-110383WM7885I83UNII-3WM7885I83DTXSID80211894EINECS 228-478-8NSC 11038RefChem:194326DTXCID10134385
Show more names
Nonanoic acid vinyl esterPelargonic acid vinyl esterNonanoic acid ethenyl ester
ethenyl nonanoateNSC11038SCHEMBL156147NWJTZFZQVYJIHU-UHFFFAOYSA-NAKOS006344452NS00043813Q27258148
Database identifiers
- CAS
6280-03-1- PubChem CID
- 80472
- DTXSID
DTXSID80211894- UNII
- 3WM7885I83
- EC Number
- 228-478-8
- Nikkaji
- J118.195E
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 9
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 141
Experimental & physicochemical properties
Food Contact SubstancesFCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
Physicochemical properties
- Melting point
- -58.7 °C · -58.7°C (rough estimate)
- Boiling point
- 133 °C · 133°C 50mm
- Density
- 0.8689 · 0.8689
- refractive index
- 1.4447 · 1.4447
- Indirect Additives used in Food Contact Substances
- VINYL PELARGONATE
- FDA 21 CFR
- 175.105 · 175.105; 176.170; 176.180
- FDA UNII
- 3 WM7885I83 · 3WM7885I83
Chemistry & industry
Suppliers3 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
安那莱（齐河）新材料科技有限公司18600642180（微信同） 13391601435 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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