Basic information
- CAS
40292-22-6- Standard SMILES
CC(C)c1ccc(C(=O)c2ccc(N)cc2)cc1- InChIKey
LOWKEYACSTXUQV-UHFFFAOYSA-N- Molecular formula
- C16H17NO
- Average molar mass
- 239.31 g/mol
- Monoisotopic mass
- 239.13101417
Names & identifiers
- Preferred name
- (4-Aminophenyl)(4-isopropylphenyl)methanone
- IUPAC
- (4-aminophenyl)-(4-propan-2-ylphenyl)methanone
- English name
- 4-amino-4'-isopropylbenzophenone
- Molecular formula
- C16H17NO
- Molecular weight
- 239.31
Names & synonyms
40292-22-6(4-aminophenyl)(4-isopropylphenyl)methanone4-Amino-4'-isopropylbenzophenone(4-Amino-phenyl)-(4-isopropyl-phenyl)-methanone(4-aminophenyl)-(4-propan-2-ylphenyl)methanoneEINECS 254-874-5SCHEMBL7776773DTXSID109607274-isopropyl- 4'-aminobenzophenoneAKOS013514212SB81189DB-257726
Show more names
4-Aminophenyl[4-(1-methylethyl)phenyl] ketoneMethanone, (4-aminophenyl)[4-(1-methylethyl)phenyl]-
NS00057470(4-Aminophenyl)[4-(propan-2-yl)phenyl]methanone
Database identifiers
- CAS
40292-22-6- PubChem CID
- 170293
- DTXSID
DTXSID10960727- EC Number
- 254-874-5
- Nikkaji
- J332.400A
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 271
Physicochemical properties
- Boiling point
- 402 · 402.0±38.0 °C(Predicted)
- Density
- 1.088 · 1.088±0.06 g/cm3(Predicted)
- pka
- 2.25 · 2.25±0.10(Predicted)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers4 total
上海书亚医药科技有限公司400-685-9117 · [email protected]
上海智乾生物科技有限公司[email protected]
Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
2 records
Compound notes
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