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Basic information
- CAS
36616-52-1- Standard SMILES
O=C(O)C(Cl)c1ccc(C2CCCCC2)c(Cl)c1- InChIKey
GXEUNRBWEAIPCN-UHFFFAOYSA-N- Molecular formula
- C14H16Cl2O2
- Average molar mass
- 287.2 g/mol
- Monoisotopic mass
- 286.0527351
Names & identifiers
- Preferred name
- Fenclorac
- IUPAC
- 2-chloro-2-(3-chloro-4-cyclohexylphenyl)acetic acid
- English name
- Fenclorac
- Molecular formula
- C14H16Cl2O2
- Molecular weight
- 287.184
Names & synonyms
Fenclorac36616-52-1FencloracoFencloracumWHR-539Chloro(3-chloro-4-cyclohexylphenyl)acetic acid5458S22S8IDTXSID5086582836616-54-3RefChem:921526DTXCID908141932-chloro-2-(3-chloro-4-cyclohexylphenyl)acetic acid
Show more names
α,3-Dichloro-4-cyclohexylbenzeneacetic acid
WHR 539Acetic acid, 2-chloro-2-(3-chloro-4-cyclohexylphenyl)-Fencloracum [INN-Latin]Fenclorac [USAN:INN]Fencloraco [INN-Spanish]BRN 1995348ALPHA,3-DICHLORO-4-CYCLOHEXYLBENZENEACETIC ACIDUNII-5458S22S8I
Database identifiers
- CAS
36616-52-1- PubChem CID
- 37494
- DTXSID
DTXSID50865828- ChEMBL
CHEMBL1614638- UNII
- 5458S22S8I
- Nikkaji
- J19.862E
Properties
Computed structural propertiesFilling in
- XLogP
- 5.3
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 290
Physicochemical properties
- FDA UNII
- 5458 S22S8I · 5458S22S8I
Chemistry & industry
Applications
UsesAnti-inflammatory.
Suppliers3 total
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
Related reactions
3 records
Compound notes
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