(3-Amino-4-chlorophenyl)(cyclopropyl)methanone
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Basic information
- CAS
57189-92-1- Standard SMILES
Nc1cc(C(=O)C2CC2)ccc1Cl- InChIKey
ZFHPNXCCVJNTHS-UHFFFAOYSA-N- Molecular formula
- C10H10ClNO
- Average molar mass
- 195.64 g/mol
- Monoisotopic mass
- 195.0450916
Names & identifiers
- Preferred name
- (3-Amino-4-chlorophenyl)(cyclopropyl)methanone
- IUPAC
- (3-amino-4-chlorophenyl)-cyclopropylmethanone
- English name
- (3-AMino-4-chlorophenyl)(cyclopropyl)Methanone
- Molecular formula
- C10H10ClNO
- Molecular weight
- 195.65
Names & synonyms
(3-Amino-4-chlorophenyl)(cyclopropyl)methanone57189-92-12-chloro-5-cyclopropanecarbonylanilineDTXSID00653570DB-327726Methanone, (3-amino-4-chlorophenyl)cyclopropyl-
Database identifiers
- CAS
57189-92-1- PubChem CID
- 39239582
- DTXSID
DTXSID00653570
Properties
Computed structural propertiesFilling in
- XLogP
- 2.4
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 215
Physicochemical properties
- Boiling point
- 366.6 · 366.6±22.0 °C(Predicted)
- Density
- 1.354 · 1.354±0.06 g/cm3(Predicted)
- pka
- 1.46 · 1.46±0.10(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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