2-Decylidenesuccinic acid
Basic information
- CAS
5768-45-6- Standard SMILES
CCCCCCCCC/C=C(/CC(=O)O)C(=O)O- InChIKey
XMNQOFCTLYALPR-BENRWUELSA-N- Molecular formula
- C14H24O4
- Average molar mass
- 256.34 g/mol
- Monoisotopic mass
- 256.16745924
Names & identifiers
- Preferred name
- 2-Decylidenesuccinic acid
- IUPAC
- (2Z)-2-decylidenebutanedioic acid
Names & synonyms
2-Decylidenesuccinic acid5768-45-67H5GJ6SR3KUNII-7H5GJ6SR3KNSC 229049NSC229049NSC-229049(2Z)-2-decylidenebutanedioic acidSuccinic acid, decylidene-2-decylidenebutanedioic acidButanedioic acid, decylidene-Butanedioic acid, 2-decylidene-
Database identifiers
- CAS
5768-45-6- PubChem CID
- 6450841
- UNII
- 7H5GJ6SR3K
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 11
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 282
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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