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4-Chlorobut-2-en-1-amine

HCID 413699
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Basic information

CAS
774474-50-9
Standard SMILES
NCC=CCCl
InChIKey
DYUZZXXUVYQTQX-UHFFFAOYSA-N
Molecular formula
C4H8ClN
Average molar mass
105.56 g/mol
Monoisotopic mass
105.034527

Names & identifiers

Preferred name
4-Chlorobut-2-en-1-amine
IUPAC
4-chlorobut-2-en-1-amine

Names & synonyms

774474-50-9DTXSID40328755RefChem:292112DTXCID102798614-Chlorobut-2-en-1-amine1-amino-4-chloro-2-buteneSCHEMBL2770935

Database identifiers

CAS
774474-50-9
PubChem CID
413699
DTXSID
DTXSID40328755

Properties

Computed structural properties

XLogP
0.2
Topological polar surface area
26 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
6
Formal charge
0
Complexity
42.8

Related reactions

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Compound notes

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