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15055-60-4 | Thiazole, 2-(2-phenylethyl)-
CAS No: 15055-60-4 Catalog No: AG001MPO MDL No:
Product Description
Catalog Number:
AG001MPO
Chemical Name:
Thiazole, 2-(2-phenylethyl)-
CAS Number:
15055-60-4
Molecular Formula:
C11H11NS
Molecular Weight:
189.2767
IUPAC Name:
2-(2-phenylethyl)-1,3-thiazole
InChI:
InChI=1S/C11H11NS/c1-2-4-10(5-3-1)6-7-11-12-8-9-13-11/h1-5,8-9H,6-7H2
InChI Key:
KEWBUOMVBFMGNS-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CCc1nccs1
Properties
Complexity:
143
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:
3
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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