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36093-97-7 | (2-(p-Tolyl)thiazol-4-yl)methanol
CAS No: 36093-97-7 Catalog No: AG007BEA MDL No:MFCD06738395
Product Description
Catalog Number:
AG007BEA
Chemical Name:
(2-(p-Tolyl)thiazol-4-yl)methanol
CAS Number:
36093-97-7
Molecular Formula:
C11H11NOS
Molecular Weight:
205.2761
MDL Number:
MFCD06738395
IUPAC Name:
[2-(4-methylphenyl)-1,3-thiazol-4-yl]methanol
InChI:
InChI=1S/C11H11NOS/c1-8-2-4-9(5-3-8)11-12-10(6-13)7-14-11/h2-5,7,13H,6H2,1H3
InChI Key:
MUQRQDVYECSELB-UHFFFAOYSA-N
SMILES:
OCc1csc(n1)c1ccc(cc1)C
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.056g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
205.275g/mol
Monoisotopic Mass:
205.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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