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Home > Aldehydes > 869211-55-2
869211-55-2 | Benzaldehyde, 4-[bis[4-[2-(4-butoxyphenyl)ethenyl]phenyl]amino]-
CAS No: 869211-55-2 Catalog No: AG004LA3 MDL No:
Product Description
Catalog Number:
AG004LA3
Chemical Name:
Benzaldehyde, 4-[bis[4-[2-(4-butoxyphenyl)ethenyl]phenyl]amino]-
CAS Number:
869211-55-2
Molecular Formula:
C43H43NO3
Molecular Weight:
621.8064
IUPAC Name:
4-[4-[2-(4-butoxyphenyl)ethenyl]-N-[4-[2-(4-butoxyphenyl)ethenyl]phenyl]anilino]benzaldehyde
InChI:
InChI=1S/C43H43NO3/c1-3-5-31-46-42-27-17-36(18-28-42)9-7-34-11-21-39(22-12-34)44(41-25-15-38(33-45)16-26-41)40-23-13-35(14-24-40)8-10-37-19-29-43(30-20-37)47-32-6-4-2/h7-30,33H,3-6,31-32H2,1-2H3
InChI Key:
NIDYLIKGEJWZKO-UHFFFAOYSA-N
SMILES:
CCCCOc1ccc(cc1)C=Cc1ccc(cc1)N(c1ccc(cc1)C=Cc1ccc(cc1)OCCCC)c1ccc(cc1)C=O
Properties
Complexity:
832
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
621.324g/mol
Formal Charge:
0
Heavy Atom Count:
47
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
621.821g/mol
Monoisotopic Mass:
621.324g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
11.6
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