Basic information
- CAS
18451-96-2- Standard SMILES
C=CCCCCCCCCC(=O)OCCCCC- InChIKey
UODPTRHAWGAWQL-UHFFFAOYSA-N- Molecular formula
- C16H30O2
- Average molar mass
- 254.41 g/mol
- Monoisotopic mass
- 254.2245802
Names & identifiers
- Preferred name
- 10-Undecenoic acid, pentyl ester
- IUPAC
- pentyl undec-10-enoate
- English name
- pentyl undec-10-enoate
- Molecular formula
- C16H30O2
- Molecular weight
- 254.41
Names & synonyms
10-Undecenoic acid, pentyl esterAmyl undecylenate18451-96-2EINECS 242-337-8DTXSID0066379RefChem:437092DTXCID1035864Pentyl undec-10-enoatePentyl 10-undecenoateSCHEMBL3111400NS0002605710-Undecenoic acid pentyl ester
Database identifiers
- CAS
18451-96-2- PubChem CID
- 87652
- DTXSID
DTXSID0066379- EC Number
- 242-337-8
- Nikkaji
- J266.187J
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 14
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 199
Physicochemical properties
- Boiling point
- 318.6 · 318.6±11.0 °C(Predicted)
- Density
- 0.873 · 0.873±0.06 g/cm3(Predicted)
- LogP
- 6.491 · 6.491 (est)
- EPA Substance Registry System
- 10 · 10-Undecenoic acid, pentyl ester (18451-96-2)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information10-Undecenoic acid, pentyl ester: ACTIVE
Suppliers1 total
上海问彩新材料科技有限公司15721586846 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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