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25021-49-2 | 4-(2-METHYL-1,3-THIAZOL-4-YL)ANILINE
CAS No: 25021-49-2 Catalog No: AG00BDKU MDL No:MFCD02691928
Product Description
Catalog Number:
AG00BDKU
Chemical Name:
4-(2-METHYL-1,3-THIAZOL-4-YL)ANILINE
CAS Number:
25021-49-2
Molecular Formula:
C10H10N2S
Molecular Weight:
190.2648
MDL Number:
MFCD02691928
IUPAC Name:
4-(2-methyl-1,3-thiazol-4-yl)aniline
InChI:
InChI=1S/C10H10N2S/c1-7-12-10(6-13-7)8-2-4-9(11)5-3-8/h2-6H,11H2,1H3
InChI Key:
JCRKEVDAEUPNAA-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)c1csc(n1)C
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.056g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.264g/mol
Monoisotopic Mass:
190.056g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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