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Home > Thiazole > 1860399-05-8
1860399-05-8 | 5-ethyl-2-ethynyl-1,3-thiazole
CAS No: 1860399-05-8 Catalog No: AG01DRHT MDL No:MFCD31463912
Product Description
Catalog Number:
AG01DRHT
Chemical Name:
5-ethyl-2-ethynyl-1,3-thiazole
CAS Number:
1860399-05-8
Molecular Formula:
C7H7NS
Molecular Weight:
137.2022
MDL Number:
MFCD31463912
IUPAC Name:
5-ethyl-2-ethynyl-1,3-thiazole
InChI:
InChI=1S/C7H7NS/c1-3-6-5-8-7(4-2)9-6/h2,5H,3H2,1H3
InChI Key:
MTDZZIUILYEFJG-UHFFFAOYSA-N
SMILES:
CCc1cnc(s1)C#C
Properties
Complexity:
135
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.03g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
137.2g/mol
Monoisotopic Mass:
137.03g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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