Basic information
- CAS
69205-08-9- Standard SMILES
CCCCCCCCC(=O)OCC(C)CC- InChIKey
VJMUYXUHYWZMAT-UHFFFAOYSA-N- Molecular formula
- C14H28O2
- Average molar mass
- 228.37 g/mol
- Monoisotopic mass
- 228.20893013
Names & identifiers
- Preferred name
- Nonanoic acid, 2-methylbutyl ester
- IUPAC
- 2-methylbutyl nonanoate
- English name
- 2-methylbutyl nonan-1-oate
- Molecular formula
- C14H28O2
- Molecular weight
- 228.37
Names & synonyms
2-Methylbutyl nonanoate2-Methylbutyl nonoate69205-08-9Nonanoic acid, 2-methylbutyl esterEINECS 273-911-6DTXSID60887652RefChem:166458DTXCID7010269392-Methylbutyl nonan-1-oateSCHEMBL28158620VJMUYXUHYWZMAT-UHFFFAOYSA-NNS00063364
Show more names
Nonanoic acid 2-methylbutyl esterNonanoic acid (2-methylbutyl) ester
Database identifiers
- CAS
69205-08-9- PubChem CID
- 112255
- DTXSID
DTXSID60887652- EC Number
- 273-911-6
- Nikkaji
- J332.817A
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 11
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 166
Physicochemical properties
- LogP
- 5.724 · 5.724 (est)
- EPA Substance Registry System
- 2 · 2-Methylbutyl nonanoate (69205-08-9)
- 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 InformationNonanoic acid, 2-methylbutyl ester: INACTIVE
Suppliers3 total
吉良化学21-62165282 · [email protected]
上海问彩新材料科技有限公司15721586846 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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