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Home > Nitro Compounds > 18150-94-2
18150-94-2 | Thiophene, 3-nitro-2-phenyl-
CAS No: 18150-94-2 Catalog No: AG0022XI MDL No:
Product Description
Catalog Number:
AG0022XI
Chemical Name:
Thiophene, 3-nitro-2-phenyl-
CAS Number:
18150-94-2
Molecular Formula:
C10H7NO2S
Molecular Weight:
205.2331
IUPAC Name:
3-nitro-2-phenylthiophene
InChI:
InChI=1S/C10H7NO2S/c12-11(13)9-6-7-14-10(9)8-4-2-1-3-5-8/h1-7H
InChI Key:
MOMYURHNCLKYIA-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccsc1c1ccccc1
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.02g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.231g/mol
Monoisotopic Mass:
205.02g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
74.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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