Aniline, p-(2-chloroethyl)-, hydrochloride
Basic information
- CAS
52273-60-6- Standard SMILES
Cl.Nc1ccc(CCCl)cc1- InChIKey
MILNNUCLKZPGAB-UHFFFAOYSA-N- Molecular formula
- C8H11Cl2N
- Average molar mass
- 192.08 g/mol
- Monoisotopic mass
- 191.0268547
Names & identifiers
- Preferred name
- Aniline, p-(2-chloroethyl)-, hydrochloride
- IUPAC
- 4-(2-chloroethyl)aniline;hydrochloride
Names & synonyms
52273-60-6Aniline, p-(2-chloroethyl)-, hydrochloride4-(2-chloroethyl)aniline hydrochloride4-(2-chloroethyl)aniline;hydrochlorideBenzenamine, 4-(2-chloroethyl)-, hydrochlorideDTXSID10966648NSC42073NSC-420734-(2-Chloroethyl)aniline--hydrogen chloride (1/1)
Database identifiers
- CAS
52273-60-6- PubChem CID
- 521376
- DTXSID
DTXSID10966648
Properties
Computed structural properties
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 87.3
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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