Home Nitros [2-(3-nitrophenyl)-1,3-thiazol-4-yl]methanol

[2-(3-nitrophenyl)-1,3-thiazol-4-yl]methanol

CAS No.:
1485767-43-8
Catalog Number:
AG01BCK7
Molecular Formula:
C10H8N2O3S
Molecular Weight:
236.2471
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Product Description
Catalog Number:
AG01BCK7
Chemical Name:
[2-(3-nitrophenyl)-1,3-thiazol-4-yl]methanol
CAS Number:
1485767-43-8
Molecular Formula:
C10H8N2O3S
Molecular Weight:
236.2471
MDL Number:
MFCD21262647
IUPAC Name:
[2-(3-nitrophenyl)-1,3-thiazol-4-yl]methanol
InChI:
InChI=1S/C10H8N2O3S/c13-5-8-6-16-10(11-8)7-2-1-3-9(4-7)12(14)15/h1-4,6,13H,5H2
InChI Key:
QAOQIVNGNVBXJI-UHFFFAOYSA-N
SMILES:
OCc1csc(n1)c1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.026g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
236.245g/mol
Monoisotopic Mass:
236.026g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties