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876013-92-2 | 2-Propenamide, 3-[3-ethenyl-4-(1-methylethoxy)phenyl]-, (2E)-
CAS No: 876013-92-2 Catalog No: AG004I38 MDL No:
Product Description
Catalog Number:
AG004I38
Chemical Name:
2-Propenamide, 3-[3-ethenyl-4-(1-methylethoxy)phenyl]-, (2E)-
CAS Number:
876013-92-2
Molecular Formula:
C14H17NO2
Molecular Weight:
231.2903
IUPAC Name:
3-(3-ethenyl-4-propan-2-yloxyphenyl)prop-2-enamide
InChI:
InChI=1S/C14H17NO2/c1-4-12-9-11(6-8-14(15)16)5-7-13(12)17-10(2)3/h4-10H,1H2,2-3H3,(H2,15,16)
InChI Key:
VVBQNRRTGJNXBF-UHFFFAOYSA-N
SMILES:
C=Cc1cc(/C=C/C(=O)N)ccc1OC(C)C
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.126g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
231.295g/mol
Monoisotopic Mass:
231.126g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.8
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