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95611-42-0 | Thiourea, trimethyl(4-methyl-2-thiazolyl)-
CAS No: 95611-42-0 Catalog No: AG00H8R3 MDL No:
Product Description
Catalog Number:
AG00H8R3
Chemical Name:
Thiourea, trimethyl(4-methyl-2-thiazolyl)-
CAS Number:
95611-42-0
Molecular Formula:
C8H13N3S2
Molecular Weight:
215.3389
IUPAC Name:
1,1,3-trimethyl-3-(4-methyl-1,3-thiazol-2-yl)thiourea
InChI:
InChI=1S/C8H13N3S2/c1-6-5-13-7(9-6)11(4)8(12)10(2)3/h5H,1-4H3
InChI Key:
QUOMBUFQQAPNOJ-UHFFFAOYSA-N
SMILES:
S=C(N(c1scc(n1)C)C)N(C)C
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.055g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.333g/mol
Monoisotopic Mass:
215.055g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
79.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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