Basic information
- CAS
64398-92-1- Standard SMILES
Clc1ccc(NCC2CO2)cc1- InChIKey
VVQPMDOXICEFEH-UHFFFAOYSA-N- Molecular formula
- C9H10ClNO
- Average molar mass
- 183.63 g/mol
- Monoisotopic mass
- 183.0450916
Names & identifiers
- Preferred name
- ANILINE, p-CHLORO-N-(2,3-EPOXYPROPYL)-
- IUPAC
- 4-chloro-N-(oxiran-2-ylmethyl)aniline
Names & synonyms
ANILINE, p-CHLORO-N-(2,3-EPOXYPROPYL)-64398-92-1N-(2:3-Epoxy-n-propyl)-p-chloro-anilineDTXSID409829724-Chloro-N-[(oxiran-2-yl)methyl]aniline
Database identifiers
- CAS
64398-92-1- PubChem CID
- 47360
- DTXSID
DTXSID40982972
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 24.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 145
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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