Basic information
- CAS
855953-89-8- Standard SMILES
CC(=O)C(Cl)CCCC(=O)O- InChIKey
WESSDJNCWDFINL-UHFFFAOYSA-N- Molecular formula
- C7H11ClO3
- Average molar mass
- 178.61 g/mol
Names & identifiers
- Preferred name
- Heptanoic acid, 5-chloro-6-oxo-
- IUPAC
- 5-chloro-6-oxoheptanoic acid
- English name
- Heptanoic acid, 5-chloro-6-oxo-
- Molecular formula
- C7H11ClO3
- Molecular weight
- 0
Names & synonyms
855953-89-8Heptanoic acid, 5-chloro-6-oxo-SCHEMBL9344183DB-326447
Database identifiers
- CAS
855953-89-8
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 156
Chemistry & industry
Suppliers1 total
济南思考化学有限公司0531-0000 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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