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81529-60-4 | 4-(2,4,6-TRIMETHYL-PHENYL)-THIAZOL-2-YLAMINE
CAS No: 81529-60-4 Catalog No: AG00590J MDL No:MFCD01534593
Product Description
Catalog Number:
AG00590J
Chemical Name:
4-(2,4,6-TRIMETHYL-PHENYL)-THIAZOL-2-YLAMINE
CAS Number:
81529-60-4
Molecular Formula:
C12H14N2S
Molecular Weight:
218.3180
MDL Number:
MFCD01534593
IUPAC Name:
4-(2,4,6-trimethylphenyl)-1,3-thiazol-2-amine
InChI:
InChI=1S/C12H14N2S/c1-7-4-8(2)11(9(3)5-7)10-6-15-12(13)14-10/h4-6H,1-3H3,(H2,13,14)
InChI Key:
QKYORNXSXAOYPV-UHFFFAOYSA-N
SMILES:
Cc1cc(C)c(c(c1)C)c1csc(n1)N
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.088g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
218.318g/mol
Monoisotopic Mass:
218.088g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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