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Home > Nitro Compounds > 109029-42-7
109029-42-7 | 4-methyl-2-(4-nitrophenyl)-1,3-thiazole
CAS No: 109029-42-7 Catalog No: AG019V0U MDL No:MFCD12197012
Product Description
Catalog Number:
AG019V0U
Chemical Name:
4-methyl-2-(4-nitrophenyl)-1,3-thiazole
CAS Number:
109029-42-7
Molecular Formula:
C10H8N2O2S
Molecular Weight:
220.2477
MDL Number:
MFCD12197012
IUPAC Name:
4-methyl-2-(4-nitrophenyl)-1,3-thiazole
InChI:
InChI=1S/C10H8N2O2S/c1-7-6-15-10(11-7)8-2-4-9(5-3-8)12(13)14/h2-6H,1H3
InChI Key:
BMJCMCZSVYVDCN-UHFFFAOYSA-N
SMILES:
Cc1csc(n1)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
236
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:
0
Isotope Atom Count:
0
Molecular Weight:
220.246g/mol
Monoisotopic Mass:
220.031g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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