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Home > Nitro Compounds > 373380-63-3
373380-63-3 | 4-nitro-2-(thiophen-2-yl)phenol
CAS No: 373380-63-3 Catalog No: AG019OTZ MDL No:MFCD07687073
Product Description
Catalog Number:
AG019OTZ
Chemical Name:
4-nitro-2-(thiophen-2-yl)phenol
CAS Number:
373380-63-3
Molecular Formula:
C10H7NO3S
Molecular Weight:
221.2325
MDL Number:
MFCD07687073
IUPAC Name:
4-nitro-2-thiophen-2-ylphenol
InChI:
InChI=1S/C10H7NO3S/c12-9-4-3-7(11(13)14)6-8(9)10-2-1-5-15-10/h1-6,12H
InChI Key:
RBRJILBGEJNBIF-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1c1cccs1)[N+](=O)[O-]
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.015g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
221.23g/mol
Monoisotopic Mass:
221.015g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
94.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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