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1247507-13-6 | N-[(2-methyl-1,3-thiazol-5-yl)methyl]prop-2-enamide
CAS No: 1247507-13-6 Catalog No: AG01AB90 MDL No:MFCD14615615
Product Description
Catalog Number:
AG01AB90
Chemical Name:
N-[(2-methyl-1,3-thiazol-5-yl)methyl]prop-2-enamide
CAS Number:
1247507-13-6
Molecular Formula:
C8H10N2OS
Molecular Weight:
182.2428
MDL Number:
MFCD14615615
IUPAC Name:
N-[(2-methyl-1,3-thiazol-5-yl)methyl]prop-2-enamide
InChI:
InChI=1S/C8H10N2OS/c1-3-8(11)10-5-7-4-9-6(2)12-7/h3-4H,1,5H2,2H3,(H,10,11)
InChI Key:
GYXNFDFCNFKHAZ-UHFFFAOYSA-N
SMILES:
Cc1ncc(s1)CNC(=O)C=C
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.051g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
182.241g/mol
Monoisotopic Mass:
182.051g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
70.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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