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101830-94-8 | 2-Propenamide, 2-methyl-N-2-thiazolyl-
CAS No: 101830-94-8 Catalog No: AG0005OK MDL No:MFCD00458154
Product Description
Catalog Number:
AG0005OK
Chemical Name:
2-Propenamide, 2-methyl-N-2-thiazolyl-
CAS Number:
101830-94-8
Molecular Formula:
C7H8N2OS
Molecular Weight:
168.2162
MDL Number:
MFCD00458154
IUPAC Name:
2-methyl-N-(1,3-thiazol-2-yl)prop-2-enamide
InChI:
InChI=1S/C7H8N2OS/c1-5(2)6(10)9-7-8-3-4-11-7/h3-4H,1H2,2H3,(H,8,9,10)
InChI Key:
UUPLFVGCURGBPN-UHFFFAOYSA-N
SMILES:
CC(=C)C(=O)Nc1nccs1
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.036g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
168.214g/mol
Monoisotopic Mass:
168.036g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
70.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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