Basic information
- CAS
121193-16-6- Standard SMILES
O=C(Cl)c1ccc(C2CCCCC2)cc1- InChIKey
MWLQEWDQXQHQED-UHFFFAOYSA-N- Molecular formula
- C13H15ClO
- Average molar mass
- 222.71 g/mol
- Monoisotopic mass
- 222.08114278
Names & identifiers
- Preferred name
- 4-Cyclohexylbenzoyl chloride
- IUPAC
- 4-cyclohexylbenzoyl chloride
- English name
- Benzoyl chloride, 4-cyclohexyl-
- Molecular formula
- C13H15ClO
- Molecular weight
- 222.7106
Names & synonyms
4-CYCLOHEXYLBENZOYL CHLORIDE121193-16-6Benzoyl chloride, 4-cyclohexyl-4-Cyclohexyl-benzoyl chloride4-cyclohexyl benzoyl chlorideSCHEMBL1692419DTXSID40619534MWLQEWDQXQHQED-UHFFFAOYSA-N4-cyclohexyl-1-benzenecarbonyl chloride
Database identifiers
- CAS
121193-16-6- PubChem CID
- 21890847
- DTXSID
DTXSID40619534
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 213
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers5 total
阳谷荣科商贸有限公司15863541132 · [email protected]
菏泽星达医药科技有限公司13583079096 · [email protected]
上海恬枫生物科技有限公司18717800556 · [email protected]
山东煜昌药业有限公司531-87153728 13805401165 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
30 records
Compound notes
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