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1401521-91-2 | 3-(3-Methyl-isothiazol-5-yl)-phenylamine
CAS No: 1401521-91-2 Catalog No: AG01FGY5 MDL No:
Product Description
Catalog Number:
AG01FGY5
Chemical Name:
3-(3-Methyl-isothiazol-5-yl)-phenylamine
CAS Number:
1401521-91-2
IUPAC Name:
3-(3-methyl-1,2-thiazol-5-yl)aniline
InChI:
InChI=1S/C10H10N2S/c1-7-5-10(13-12-7)8-3-2-4-9(11)6-8/h2-6H,11H2,1H3
InChI Key:
DDBXUBINDJUMMH-UHFFFAOYSA-N
Properties
Complexity:
174
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:
2.4
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