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675202-66-1 | Benzaldehyde, 4-[2-[4-(1,1-dimethylethyl)phenyl]-2-phenylethenyl]-
CAS No: 675202-66-1 Catalog No: AG005MY5 MDL No:
Product Description
Catalog Number:
AG005MY5
Chemical Name:
Benzaldehyde, 4-[2-[4-(1,1-dimethylethyl)phenyl]-2-phenylethenyl]-
CAS Number:
675202-66-1
Molecular Formula:
C25H24O
Molecular Weight:
340.4575
IUPAC Name:
4-[2-(4-tert-butylphenyl)-2-phenylethenyl]benzaldehyde
InChI:
InChI=1S/C25H24O/c1-25(2,3)23-15-13-22(14-16-23)24(21-7-5-4-6-8-21)17-19-9-11-20(18-26)12-10-19/h4-18H,1-3H3
InChI Key:
XCTUSAIZKUDQIS-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)C=C(c1ccc(cc1)C(C)(C)C)c1ccccc1
Properties
Complexity:
461
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
340.183g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
340.466g/mol
Monoisotopic Mass:
340.183g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
7.2
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