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182817-99-8 | 2-Propenamide, 3-(4-hydroxy-3-methoxyphenyl)-N-octyl-
CAS No: 182817-99-8 Catalog No: AG002451 MDL No:
Product Description
Catalog Number:
AG002451
Chemical Name:
2-Propenamide, 3-(4-hydroxy-3-methoxyphenyl)-N-octyl-
CAS Number:
182817-99-8
Molecular Formula:
C18H27NO3
Molecular Weight:
305.4119
IUPAC Name:
3-(4-hydroxy-3-methoxyphenyl)-N-octylprop-2-enamide
InChI:
InChI=1S/C18H27NO3/c1-3-4-5-6-7-8-13-19-18(21)12-10-15-9-11-16(20)17(14-15)22-2/h9-12,14,20H,3-8,13H2,1-2H3,(H,19,21)
InChI Key:
CNZGHLAXLFAZJR-UHFFFAOYSA-N
SMILES:
CCCCCCCCNC(=O)C=Cc1ccc(c(c1)OC)O
Properties
Complexity:
330
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.199g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
305.418g/mol
Monoisotopic Mass:
305.199g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.7
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