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2928-35-0 | [1,1'-Biphenyl]-2-carboxaldehyde, 4,6-diethyl-
CAS No: 2928-35-0 Catalog No: AG002XYJ MDL No:
Product Description
Catalog Number:
AG002XYJ
Chemical Name:
[1,1'-Biphenyl]-2-carboxaldehyde, 4,6-diethyl-
CAS Number:
2928-35-0
Molecular Formula:
C17H18O
Molecular Weight:
238.3242
IUPAC Name:
3,5-diethyl-2-phenylbenzaldehyde
InChI:
InChI=1S/C17H18O/c1-3-13-10-14(4-2)17(16(11-13)12-18)15-8-6-5-7-9-15/h5-12H,3-4H2,1-2H3
InChI Key:
LSBXBRDHJTUDKW-UHFFFAOYSA-N
SMILES:
CCc1cc(CC)c(c(c1)C=O)c1ccccc1
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.136g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.33g/mol
Monoisotopic Mass:
238.136g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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