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937651-99-5 | [2-(3-methoxyphenyl)-1,3-thiazol-5-yl]methanol
CAS No: 937651-99-5 Catalog No: AG00J841 MDL No:MFCD09694154
Product Description
Catalog Number:
AG00J841
Chemical Name:
[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]methanol
CAS Number:
937651-99-5
Molecular Formula:
C11H11NO2S
Molecular Weight:
221.2755
MDL Number:
MFCD09694154
IUPAC Name:
[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]methanol
InChI:
InChI=1S/C11H11NO2S/c1-14-9-4-2-3-8(5-9)11-12-6-10(7-13)15-11/h2-6,13H,7H2,1H3
InChI Key:
IGQCDZVDJSFVFG-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)c1ncc(s1)CO
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.051g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
221.274g/mol
Monoisotopic Mass:
221.051g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
70.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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