Basic information
- CAS
7497-59-8- Standard SMILES
COc1ccc(C(=O)c2cc(Cl)ccc2N)cc1- InChIKey
NRIUXRXDBVAPGT-UHFFFAOYSA-N- Molecular formula
- C14H12ClNO2
- Average molar mass
- 261.7 g/mol
Names & identifiers
- Preferred name
- (2-Amino-5-chlorophenyl)(4-methoxyphenyl)methanone
- IUPAC
- (2-amino-5-chlorophenyl)-(4-methoxyphenyl)methanone
- English name
- NSC406622
- Molecular formula
- C14H12ClNO2
- Molecular weight
- 261.7
Names & synonyms
(2-amino-5-chlorophenyl)(4-methoxyphenyl)methanoneNSC406622SCHEMBL3525434SCHEMBL30045087NRIUXRXDBVAPGT-UHFFFAOYSA-NMFCD09842794AKOS008967487NSC-4066222-Amino-4'-methoxy-5-chlorobenzophenone2-Amino-5-chloro-4?-methoxybenzophenoneFA184089(2-Amino-5-chloro-phenyl)-(4-methoxy-phenyl)-methanone
Show more names
(2-aMino-5-chloro-phenyl)-(4-Methoxyphenyl)MethanoneMethanone, (2-amino-5-chlorophenyl)(4-methoxyphenyl)-
Database identifiers
- CAS
7497-59-8- PubChem CID
- 347770
- Nikkaji
- J1.793.099K
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 290
Physicochemical properties
- Melting point
- 100 · 100-101 °C
- Boiling point
- 457.3 · 457.3±45.0 °C(Predicted)
- Density
- 1.271 · 1.271±0.06 g/cm3(Predicted)
- pka
- -0.52 · -0.52±0.10(Predicted)
Chemistry & industry
Suppliers4 total
上海相辉医药科技有限公司[email protected]
西安速加医药科技有限公司029-86115547 17791676824 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
Cochemical Co. Ltd.+86-029-86115547 +86-17791676824 · [email protected]
Related reactions
3 records
Compound notes
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