Basic information
- CAS
85325-03-7- Standard SMILES
CCCC1CCC(c2ccc(CC(=O)Cl)cc2)CC1- InChIKey
ZJHULADUMZQTLK-UHFFFAOYSA-N- Molecular formula
- C17H23ClO
- Average molar mass
- 278.8 g/mol
- Monoisotopic mass
- 278.143743
Names & identifiers
- Preferred name
- [4-(4-Propylcyclohexyl)phenyl]acetyl chloride
- IUPAC
- 2-[4-(4-propylcyclohexyl)phenyl]acetyl chloride
Names & synonyms
85325-03-7[4-(4-Propylcyclohexyl)phenyl]acetyl chlorideSCHEMBL10500796SCHEMBL10733328DTXSID90545394ZJHULADUMZQTLK-CTYIDZIISA-N4-(trans-4-n-propylcyclohexyl)-phenylacetyl chloride
Database identifiers
- CAS
85325-03-7- PubChem CID
- 13628417
- DTXSID
DTXSID90545394
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 273
Related reactions
1 records
Compound notes
Loading…