Home Halogens 3-amino-1-chlorobutan-2-one hydrochloride

3-amino-1-chlorobutan-2-one hydrochloride

CAS No.:
36077-43-7
Catalog Number:
AG01C1EY
Molecular Formula:
C4H9Cl2NO
Molecular Weight:
158.0264
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Product Description
Catalog Number:
AG01C1EY
Chemical Name:
3-amino-1-chlorobutan-2-one hydrochloride
CAS Number:
36077-43-7
Molecular Formula:
C4H9Cl2NO
Molecular Weight:
158.0264
MDL Number:
MFCD29047270
IUPAC Name:
3-amino-1-chlorobutan-2-one;hydrochloride
InChI:
InChI=1S/C4H8ClNO.ClH/c1-3(6)4(7)2-5;/h3H,2,6H2,1H3;1H
InChI Key:
BLTRZHHWBHQJBA-UHFFFAOYSA-N
SMILES:
CC(C(=O)CCl)N.Cl
Properties
Complexity:
74.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.006g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
158.022g/mol
Monoisotopic Mass:
157.006g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties