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74731-19-4 | 1H-Imidazole-1-carbonylchloride
CAS No: 74731-19-4 Catalog No: AG005UJB MDL No:
Product Description
Catalog Number:
AG005UJB
Chemical Name:
1H-Imidazole-1-carbonylchloride
CAS Number:
74731-19-4
Molecular Formula:
C4H3ClN2O
Molecular Weight:
130.5324
IUPAC Name:
imidazole-1-carbonyl chloride
InChI:
InChI=1S/C4H3ClN2O/c5-4(8)7-2-1-6-3-7/h1-3H
InChI Key:
XOVUITMHPFXQPN-UHFFFAOYSA-N
SMILES:
ClC(=O)n1cncc1
Properties
Complexity:
106
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
129.993g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
130.531g/mol
Monoisotopic Mass:
129.993g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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