(1,1'-Biphenyl)-4-ylphenylmethanethione
Basic information
- CAS
1450-32-4- Standard SMILES
S=C(c1ccccc1)c1ccc(-c2ccccc2)cc1- InChIKey
ZXTNRGKNNFUCMX-UHFFFAOYSA-N- Molecular formula
- C19H14S
- Average molar mass
- 274.4 g/mol
- Monoisotopic mass
- 274.08162162
Names & identifiers
- Preferred name
- (1,1'-Biphenyl)-4-ylphenylmethanethione
- IUPAC
- phenyl-(4-phenylphenyl)methanethione
- English name
- phenyl-(4-phenylphenyl)methanethione
- Molecular formula
- C19H14S
- Molecular weight
- 0
Names & synonyms
1450-32-4(1,1'-Biphenyl)-4-ylphenylmethanethione[1,1'-Biphenyl]-4-ylphenylmethanethioneRefChem:204049phenyl-(4-phenylphenyl)methanethione([1,1'-Biphenyl]-4-yl)(phenyl)methanethioneNSC 402551NSC4025514-phenylthiobenzophenoneSCHEMBL4253421DTXSID40322970NSC-402551
Database identifiers
- CAS
1450-32-4- PubChem CID
- 345154
- DTXSID
DTXSID40322970
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 32.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 302
Chemistry & industry
Upstream & downstream products
Upstream raw materials
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Compound notes
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