Home Halogens 2-chloro-1-(1-methyl-1H-imidazol-2-yl)ethan-1-one

2-chloro-1-(1-methyl-1H-imidazol-2-yl)ethan-1-one

CAS No.:
860772-72-1
Catalog Number:
AG019ZU2
Molecular Formula:
C6H7ClN2O
Molecular Weight:
158.5856
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Product Description
Catalog Number:
AG019ZU2
Chemical Name:
2-chloro-1-(1-methyl-1H-imidazol-2-yl)ethan-1-one
CAS Number:
860772-72-1
Molecular Formula:
C6H7ClN2O
Molecular Weight:
158.5856
MDL Number:
MFCD16878432
IUPAC Name:
2-chloro-1-(1-methylimidazol-2-yl)ethanone
InChI:
InChI=1S/C6H7ClN2O/c1-9-3-2-8-6(9)5(10)4-7/h2-3H,4H2,1H3
InChI Key:
MLIMAEFXKFJJSR-UHFFFAOYSA-N
SMILES:
ClCC(=O)c1nccn1C
Properties
Complexity:
140  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.025g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.585g/mol
Monoisotopic Mass:
158.025g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties