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Home > Imidazoles > 2138379-80-1
2138379-80-1 | 2-(2-methyl-5-nitro-1H-imidazol-1-yl)acetyl chloride hydrochloride
CAS No: 2138379-80-1 Catalog No: AG01EMNT MDL No:MFCD31559374
Product Description
Catalog Number:
AG01EMNT
Chemical Name:
2-(2-methyl-5-nitro-1H-imidazol-1-yl)acetyl chloride hydrochloride
CAS Number:
2138379-80-1
Molecular Formula:
C6H7Cl2N3O3
Molecular Weight:
240.0441
MDL Number:
MFCD31559374
IUPAC Name:
2-(2-methyl-5-nitroimidazol-1-yl)acetyl chloride;hydrochloride
InChI:
InChI=1S/C6H6ClN3O3.ClH/c1-4-8-2-6(10(12)13)9(4)3-5(7)11;/h2H,3H2,1H3;1H
InChI Key:
RZYIUBHTRGOMIQ-UHFFFAOYSA-N
SMILES:
ClC(=O)Cn1c(C)ncc1[N+](=O)[O-].Cl
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.986g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
240.04g/mol
Monoisotopic Mass:
238.986g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
80.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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