Basic information
- CAS
63906-98-9- Standard SMILES
C=CCOC(C)C(=O)OC(=O)CCCCCCCC- InChIKey
SJNNFQVMAYYPQE-UHFFFAOYSA-N- Molecular formula
- C15H26O4
- Average molar mass
- 270.36 g/mol
- Monoisotopic mass
- 270.18310931
Names & identifiers
- Preferred name
- Nonanoic acid, ester with allyl lactate
- IUPAC
- 2-prop-2-enoxypropanoyl nonanoate
Names & synonyms
NONANOIC ACID, ESTER with ALLYL LACTATERefChem:109255263906-98-9BRN 1712947Pelargonic acid, ester with allyl lactateNSC 4049813-03-00-00487 (Beilstein Handbook Reference)
Database identifiers
- CAS
63906-98-9- PubChem CID
- 45182
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 13
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 273
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…