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131786-51-1 | 5-methyl-2-(thiophen-2-yl)-1,3-thiazol-4-ol
CAS No: 131786-51-1 Catalog No: AG00IOSI MDL No:MFCD00172531
Product Description
Catalog Number:
AG00IOSI
Chemical Name:
5-methyl-2-(thiophen-2-yl)-1,3-thiazol-4-ol
CAS Number:
131786-51-1
Molecular Formula:
C8H7NOS2
Molecular Weight:
197.2773
MDL Number:
MFCD00172531
IUPAC Name:
5-methyl-2-thiophen-2-yl-1,3-thiazol-4-ol
InChI:
InChI=1S/C8H7NOS2/c1-5-7(10)9-8(12-5)6-3-2-4-11-6/h2-4,10H,1H3
InChI Key:
FZOJPSGILYRFTG-UHFFFAOYSA-N
SMILES:
Oc1nc(sc1C)c1cccs1
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.997g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
197.27g/mol
Monoisotopic Mass:
196.997g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
89.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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