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1220-08-2 | Benzaldehyde, 4,4'-(1,2-ethanediyl)bis-
CAS No: 1220-08-2 Catalog No: AG0016JJ MDL No:
Product Description
Catalog Number:
AG0016JJ
Chemical Name:
Benzaldehyde, 4,4'-(1,2-ethanediyl)bis-
CAS Number:
1220-08-2
Molecular Formula:
C16H14O2
Molecular Weight:
238.2812
IUPAC Name:
4-[2-(4-formylphenyl)ethyl]benzaldehyde
InChI:
InChI=1S/C16H14O2/c17-11-15-7-3-13(4-8-15)1-2-14-5-9-16(12-18)10-6-14/h3-12H,1-2H2
InChI Key:
OIFGRECGCKJKMR-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)CCc1ccc(cc1)C=O
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.099g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.286g/mol
Monoisotopic Mass:
238.099g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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