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15055-58-0 | Thiazole, 5-methyl-2-(phenylmethyl)-
CAS No: 15055-58-0 Catalog No: AG001MPP MDL No:
Product Description
Catalog Number:
AG001MPP
Chemical Name:
Thiazole, 5-methyl-2-(phenylmethyl)-
CAS Number:
15055-58-0
Molecular Formula:
C11H11NS
Molecular Weight:
189.2767
IUPAC Name:
2-benzyl-5-methyl-1,3-thiazole
InChI:
InChI=1S/C11H11NS/c1-9-8-12-11(13-9)7-10-5-3-2-4-6-10/h2-6,8H,7H2,1H3
InChI Key:
CDHCIQSRFUJKMH-UHFFFAOYSA-N
SMILES:
Cc1cnc(s1)Cc1ccccc1
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.061g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.276g/mol
Monoisotopic Mass:
189.061g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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