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Home > Thiazole > 1663518-39-5
1663518-39-5 | methyl 3-(4-methyl-1,3-thiazol-5-yl)prop-2-enoate
CAS No: 1663518-39-5 Catalog No: AG01AFDA MDL No:MFCD24134986
Product Description
Catalog Number:
AG01AFDA
Chemical Name:
methyl 3-(4-methyl-1,3-thiazol-5-yl)prop-2-enoate
CAS Number:
1663518-39-5
Molecular Formula:
C8H9NO2S
Molecular Weight:
183.2276
MDL Number:
MFCD24134986
IUPAC Name:
methyl 3-(4-methyl-1,3-thiazol-5-yl)prop-2-enoate
InChI:
InChI=1S/C8H9NO2S/c1-6-7(12-5-9-6)3-4-8(10)11-2/h3-5H,1-2H3
InChI Key:
NBBKPGXEDJDKPE-UHFFFAOYSA-N
SMILES:
COC(=O)C=Cc1scnc1C
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.035g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.225g/mol
Monoisotopic Mass:
183.035g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.7
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