Home Halogens 3-chlorobutanoyl chloride

3-chlorobutanoyl chloride

CAS No.:
1951-11-7
Catalog Number:
AG01BTH8
Molecular Formula:
C4H6Cl2O
Molecular Weight:
140.9958
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Product Description
Catalog Number:
AG01BTH8
Chemical Name:
3-chlorobutanoyl chloride
CAS Number:
1951-11-7
Molecular Formula:
C4H6Cl2O
Molecular Weight:
140.9958
MDL Number:
MFCD02258930
IUPAC Name:
3-chlorobutanoyl chloride
InChI:
InChI=1S/C4H6Cl2O/c1-3(5)2-4(6)7/h3H,2H2,1H3
InChI Key:
ATANUYPSKXKEDC-UHFFFAOYSA-N
SMILES:
CC(CC(=O)Cl)Cl
Properties
Complexity:
72.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.98g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
140.991g/mol
Monoisotopic Mass:
139.98g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties