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89152-85-2 | 4-Thiazolemethanamine,2-(3-methylphenyl)-
CAS No: 89152-85-2 Catalog No: AG003WZ1 MDL No:MFCD04055034
Product Description
Catalog Number:
AG003WZ1
Chemical Name:
4-Thiazolemethanamine,2-(3-methylphenyl)-
CAS Number:
89152-85-2
Molecular Formula:
C11H12N2S
Molecular Weight:
204.2914
MDL Number:
MFCD04055034
IUPAC Name:
[2-(3-methylphenyl)-1,3-thiazol-4-yl]methanamine
InChI:
InChI=1S/C11H12N2S/c1-8-3-2-4-9(5-8)11-13-10(6-12)7-14-11/h2-5,7H,6,12H2,1H3
InChI Key:
DBRGOSWTMATQKR-UHFFFAOYSA-N
SMILES:
NCc1csc(n1)c1cccc(c1)C
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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