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Home > Nitro Compounds > 20751-81-9
20751-81-9 | Thiazole, 2,4-dimethyl-5-nitro-
CAS No: 20751-81-9 Catalog No: AG002J3D MDL No:
Product Description
Catalog Number:
AG002J3D
Chemical Name:
Thiazole, 2,4-dimethyl-5-nitro-
CAS Number:
20751-81-9
Molecular Formula:
C5H6N2O2S
Molecular Weight:
158.1783
IUPAC Name:
2,4-dimethyl-5-nitro-1,3-thiazole
InChI:
InChI=1S/C5H6N2O2S/c1-3-5(7(8)9)10-4(2)6-3/h1-2H3
InChI Key:
BYPDKSUPMPAFPC-UHFFFAOYSA-N
SMILES:
Cc1nc(c(s1)[N+](=O)[O-])C
NSC Number:
170608
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.015g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.175g/mol
Monoisotopic Mass:
158.015g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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