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Home > Imidazoles > 2073066-52-9
2073066-52-9 | 1-methyl-1H-imidazole-2-carbonyl chloride hydrochloride
CAS No: 2073066-52-9 Catalog No: AG01EMN0 MDL No:
Product Description
Catalog Number:
AG01EMN0
Chemical Name:
1-methyl-1H-imidazole-2-carbonyl chloride hydrochloride
CAS Number:
2073066-52-9
Molecular Formula:
C5H6Cl2N2O
Molecular Weight:
181.0199
IUPAC Name:
1-methylimidazole-2-carbonyl chloride;hydrochloride
InChI:
InChI=1S/C5H5ClN2O.ClH/c1-8-3-2-7-5(8)4(6)9;/h2-3H,1H3;1H
InChI Key:
IVUSXNLLNFYPQJ-UHFFFAOYSA-N
SMILES:
ClC(=O)c1nccn1C.Cl
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.986g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
181.016g/mol
Monoisotopic Mass:
179.986g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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