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885280-68-2 | (2-(o-Tolyl);thiazol-4-yl);methanamine
CAS No: 885280-68-2 Catalog No: AG0045QA MDL No:MFCD06738419
Product Description
Catalog Number:
AG0045QA
Chemical Name:
(2-(o-Tolyl);thiazol-4-yl);methanamine
CAS Number:
885280-68-2
Molecular Formula:
C11H12N2S
Molecular Weight:
204.2914
MDL Number:
MFCD06738419
IUPAC Name:
[2-(2-methylphenyl)-1,3-thiazol-4-yl]methanamine
InChI:
InChI=1S/C11H12N2S/c1-8-4-2-3-5-10(8)11-13-9(6-12)7-14-11/h2-5,7H,6,12H2,1H3
InChI Key:
NGKRWTGCZXPKCO-UHFFFAOYSA-N
SMILES:
NCc1csc(n1)c1ccccc1C
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.072g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.291g/mol
Monoisotopic Mass:
204.072g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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