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885280-43-3 | [2-(4-ETHYL-PHENYL)-THIAZOL-4-YL]-METHANOL
CAS No: 885280-43-3 Catalog No: AG00GS2B MDL No:MFCD06738398
Product Description
Catalog Number:
AG00GS2B
Chemical Name:
[2-(4-ETHYL-PHENYL)-THIAZOL-4-YL]-METHANOL
CAS Number:
885280-43-3
Molecular Formula:
C12H13NOS
Molecular Weight:
219.3027
MDL Number:
MFCD06738398
IUPAC Name:
[2-(4-ethylphenyl)-1,3-thiazol-4-yl]methanol
InChI:
InChI=1S/C12H13NOS/c1-2-9-3-5-10(6-4-9)12-13-11(7-14)8-15-12/h3-6,8,14H,2,7H2,1H3
InChI Key:
HMKOEXBFDQZHAB-UHFFFAOYSA-N
SMILES:
CCc1ccc(cc1)c1scc(n1)CO
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.072g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
219.302g/mol
Monoisotopic Mass:
219.072g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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