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Home > Thiazole > 1003313-20-9
1003313-20-9 | 1-(4-METHYL-1,3-THIAZOL-2-YL)PROP-2-EN-1-ONE
CAS No: 1003313-20-9 Catalog No: AG01BZ6P MDL No:MFCD24711962
Product Description
Catalog Number:
AG01BZ6P
Chemical Name:
1-(4-METHYL-1,3-THIAZOL-2-YL)PROP-2-EN-1-ONE
CAS Number:
1003313-20-9
Molecular Formula:
C7H7NOS
Molecular Weight:
153.2016
MDL Number:
MFCD24711962
IUPAC Name:
1-(4-methyl-1,3-thiazol-2-yl)prop-2-en-1-one
InChI:
InChI=1S/C7H7NOS/c1-3-6(9)7-8-5(2)4-10-7/h3-4H,1H2,2H3
InChI Key:
AXYVJCRTDULZPD-UHFFFAOYSA-N
SMILES:
Cc1csc(n1)C(=O)C=C
Properties
Complexity:
158
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.025g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
153.199g/mol
Monoisotopic Mass:
153.025g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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