200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 4533-42-0
4533-42-0 | 1-(4-Nitrophenyl)-1H-pyrrole
CAS No: 4533-42-0 Catalog No: AG003AZA MDL No:MFCD00119340
Product Description
Catalog Number:
AG003AZA
Chemical Name:
1-(4-Nitrophenyl)-1H-pyrrole
CAS Number:
4533-42-0
Molecular Formula:
C10H8N2O2
Molecular Weight:
188.1827
MDL Number:
MFCD00119340
IUPAC Name:
1-(4-nitrophenyl)pyrrole
InChI:
InChI=1S/C10H8N2O2/c13-12(14)10-5-3-9(4-6-10)11-7-1-2-8-11/h1-8H
InChI Key:
PWCFKNYSCGRNRW-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)n1cccc1
NSC Number:
116803
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.059g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.186g/mol
Monoisotopic Mass:
188.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.