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189209-81-2 | Thiourea, N'-(2-bromo-4-methylphenyl)-N,N-dimethyl-
CAS No: 189209-81-2 Catalog No: AG002I1Y MDL No:
Product Description
Catalog Number:
AG002I1Y
Chemical Name:
Thiourea, N'-(2-bromo-4-methylphenyl)-N,N-dimethyl-
CAS Number:
189209-81-2
Molecular Formula:
C10H13BrN2S
Molecular Weight:
273.1926
IUPAC Name:
3-(2-bromo-4-methylphenyl)-1,1-dimethylthiourea
InChI:
InChI=1S/C10H13BrN2S/c1-7-4-5-9(8(11)6-7)12-10(14)13(2)3/h4-6H,1-3H3,(H,12,14)
InChI Key:
QVPYMPDYMFOSOC-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)Br)NC(=S)N(C)C
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.998g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
273.192g/mol
Monoisotopic Mass:
271.998g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
47.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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