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21036-67-9 | Thiazole, 2-methyl-4-(2-thienyl)-
CAS No: 21036-67-9 Catalog No: AG002KQZ MDL No:MFCD01116539
Product Description
Catalog Number:
AG002KQZ
Chemical Name:
Thiazole, 2-methyl-4-(2-thienyl)-
CAS Number:
21036-67-9
Molecular Formula:
C8H7NS2
Molecular Weight:
181.2779
MDL Number:
MFCD01116539
IUPAC Name:
2-methyl-4-thiophen-2-yl-1,3-thiazole
InChI:
InChI=1S/C8H7NS2/c1-6-9-7(5-11-6)8-3-2-4-10-8/h2-5H,1H3
InChI Key:
HILMKDNBZMYHDJ-UHFFFAOYSA-N
SMILES:
Cc1scc(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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