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89942-95-0 | Thiazole, 2-(2-thienyl)-4-Methyl-
CAS No: 89942-95-0 Catalog No: AG00H4HC MDL No:MFCD01250485
Product Description
Catalog Number:
AG00H4HC
Chemical Name:
Thiazole, 2-(2-thienyl)-4-Methyl-
CAS Number:
89942-95-0
Molecular Formula:
C8H7NS2
Molecular Weight:
181.2779
MDL Number:
MFCD01250485
IUPAC Name:
4-methyl-2-thiophen-2-yl-1,3-thiazole
InChI:
InChI=1S/C8H7NS2/c1-6-5-11-8(9-6)7-3-2-4-10-7/h2-5H,1H3
InChI Key:
JFNMEDQHLIJSKA-UHFFFAOYSA-N
SMILES:
Cc1csc(n1)c1cccs1
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.002g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.271g/mol
Monoisotopic Mass:
181.002g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
69.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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