5-(3-Chlorophenyl)-2-methylphenol

HCID 53218878

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Basic information

CAS: 1261923-13-0
Standard SMILES: Cc1ccc(-c2cccc(Cl)c2)cc1O
InChIKey: JXLPFERFPYDQRX-UHFFFAOYSA-N
Molecular formula: C13H11ClO
Average molar mass: 218.68 g/mol
Monoisotopic mass: 218.0498427

Names & identifiers

Preferred name: 5-(3-Chlorophenyl)-2-methylphenol
IUPAC: 5-(3-chlorophenyl)-2-methylphenol

Names & synonyms

1261923-13-05-(3-CHLOROPHENYL)-2-METHYLPHENOL3'-Chloro-4-methyl-[1,1'-biphenyl]-3-olMFCD18313186DTXSID406837755-(3-chlorophenyl)-2-methyl-phenol5-(3-Chlorophenyl)-2-methylphenol, 95%3'-Chloro-4-methyl[1,1'-biphenyl]-3-olA1-114050

Database identifiers

CAS: 1261923-13-0
PubChem CID: 53218878
DTXSID: DTXSID40683775

Properties

Computed structural properties

XLogP: 4.2
Topological polar surface area: 20.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 15
Formal charge: 0
Complexity: 207

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