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101567-11-7 | 2-Propenamide, 2-methyl-N-[(1R)-1-phenylethyl]-
CAS No: 101567-11-7 Catalog No: AG0004TX MDL No:
Product Description
Catalog Number:
AG0004TX
Chemical Name:
2-Propenamide, 2-methyl-N-[(1R)-1-phenylethyl]-
CAS Number:
101567-11-7
Molecular Formula:
C12H15NO
Molecular Weight:
189.2536
IUPAC Name:
2-methyl-N-[(1R)-1-phenylethyl]prop-2-enamide
InChI:
InChI=1S/C12H15NO/c1-9(2)12(14)13-10(3)11-7-5-4-6-8-11/h4-8,10H,1H2,2-3H3,(H,13,14)/t10-/m1/s1
InChI Key:
JFLWLYFJFFNEMV-SNVBAGLBSA-N
SMILES:
C[C@H](c1ccccc1)NC(=O)C(=C)C
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
189.115g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.258g/mol
Monoisotopic Mass:
189.115g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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