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Home > Nitro Compounds > 83454-12-0
83454-12-0 | N,N-Dimethyl-N'-(4-methyl-5-nitrothiazol-2-yl)thiourea
CAS No: 83454-12-0 Catalog No: AG00GK1R MDL No:
Product Description
Catalog Number:
AG00GK1R
Chemical Name:
N,N-Dimethyl-N'-(4-methyl-5-nitrothiazol-2-yl)thiourea
CAS Number:
83454-12-0
IUPAC Name:
1,1-dimethyl-3-(4-methyl-5-nitro-1,3-thiazol-2-yl)thiourea
InChI:
InChI=1S/C7H10N4O2S2/c1-4-5(11(12)13)15-6(8-4)9-7(14)10(2)3/h1-3H3,(H,8,9,14)
InChI Key:
BNGUEEVJHSXFTK-UHFFFAOYSA-N
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.025g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
246.303g/mol
Monoisotopic Mass:
246.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
134A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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