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Home > Nitro Compounds > 405170-93-6
405170-93-6 | 2-nitro-4-(thiophen-2-yl)aniline
CAS No: 405170-93-6 Catalog No: AG01C57Z MDL No:MFCD27950461
Product Description
Catalog Number:
AG01C57Z
Chemical Name:
2-nitro-4-(thiophen-2-yl)aniline
CAS Number:
405170-93-6
Molecular Formula:
C10H8N2O2S
Molecular Weight:
220.2477
MDL Number:
MFCD27950461
IUPAC Name:
2-nitro-4-thiophen-2-ylaniline
InChI:
InChI=1S/C10H8N2O2S/c11-8-4-3-7(6-9(8)12(13)14)10-2-1-5-15-10/h1-6H,11H2
InChI Key:
YAYYYILNXVGFEZ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1N)c1cccs1
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.031g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
220.246g/mol
Monoisotopic Mass:
220.031g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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