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158319-78-9 | Benzenamine, 4-ethoxy-N-[(3,4,5-trimethoxyphenyl)methylene]-
CAS No: 158319-78-9 Catalog No: AG001Q41 MDL No:
Product Description
Catalog Number:
AG001Q41
Chemical Name:
Benzenamine, 4-ethoxy-N-[(3,4,5-trimethoxyphenyl)methylene]-
CAS Number:
158319-78-9
Molecular Formula:
C18H21NO4
Molecular Weight:
315.3636
IUPAC Name:
N-(4-ethoxyphenyl)-1-(3,4,5-trimethoxyphenyl)methanimine
InChI:
InChI=1S/C18H21NO4/c1-5-23-15-8-6-14(7-9-15)19-12-13-10-16(20-2)18(22-4)17(11-13)21-3/h6-12H,5H2,1-4H3
InChI Key:
WMJHLUPXBDYNAF-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)N=Cc1cc(OC)c(c(c1)OC)OC
NSC Number:
651020
Properties
Complexity:
341
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.147g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
315.369g/mol
Monoisotopic Mass:
315.147g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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