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91606-35-8 | 1H-Pyrrole, 2-chloro-1-methyl-5-nitro-
CAS No: 91606-35-8 Catalog No: AG006FSO MDL No:
Product Description
Catalog Number:
AG006FSO
Chemical Name:
1H-Pyrrole, 2-chloro-1-methyl-5-nitro-
CAS Number:
91606-35-8
Molecular Formula:
C5H5ClN2O2
Molecular Weight:
160.5584
IUPAC Name:
2-chloro-1-methyl-5-nitropyrrole
InChI:
InChI=1S/C5H5ClN2O2/c1-7-4(6)2-3-5(7)8(9)10/h2-3H,1H3
InChI Key:
WCGCXYQRZYUNDA-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(n1C)Cl
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.004g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.557g/mol
Monoisotopic Mass:
160.004g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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