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175135-54-3 | 1H-Pyrrole, 1-(2,5-dichloro-4-nitrophenyl)-
CAS No: 175135-54-3 Catalog No: AG00207P MDL No:MFCD00067792
Product Description
Catalog Number:
AG00207P
Chemical Name:
1H-Pyrrole, 1-(2,5-dichloro-4-nitrophenyl)-
CAS Number:
175135-54-3
Molecular Formula:
C10H6Cl2N2O2
Molecular Weight:
257.0728
MDL Number:
MFCD00067792
IUPAC Name:
1-(2,5-dichloro-4-nitrophenyl)pyrrole
InChI:
InChI=1S/C10H6Cl2N2O2/c11-7-6-10(14(15)16)8(12)5-9(7)13-3-1-2-4-13/h1-6H
InChI Key:
AOWBNTITDQLWTN-UHFFFAOYSA-N
SMILES:
Clc1cc([N+](=O)[O-])c(cc1n1cccc1)Cl
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.981g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.07g/mol
Monoisotopic Mass:
255.981g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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