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67468-65-9 | 4-Benzylbenzaldehyde
CAS No: 67468-65-9 Catalog No: AG006167 MDL No:MFCD01666418
Product Description
Catalog Number:
AG006167
Chemical Name:
4-Benzylbenzaldehyde
CAS Number:
67468-65-9
Molecular Formula:
C14H12O
Molecular Weight:
196.2445
MDL Number:
MFCD01666418
IUPAC Name:
4-benzylbenzaldehyde
InChI:
InChI=1S/C14H12O/c15-11-14-8-6-13(7-9-14)10-12-4-2-1-3-5-12/h1-9,11H,10H2
InChI Key:
DHARILAASAAGJJ-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)Cc1ccccc1
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.089g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.249g/mol
Monoisotopic Mass:
196.089g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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