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Home > Aldehydes > 850222-68-3
850222-68-3 | Benzaldehyde, 4-(bicyclo[2.2.1]hept-5-en-2-ylmethoxy)-
CAS No: 850222-68-3 Catalog No: AG0050OQ MDL No:
Product Description
Catalog Number:
AG0050OQ
Chemical Name:
Benzaldehyde, 4-(bicyclo[2.2.1]hept-5-en-2-ylmethoxy)-
CAS Number:
850222-68-3
Molecular Formula:
C15H16O2
Molecular Weight:
228.2863
IUPAC Name:
4-(2-bicyclo[2.2.1]hept-5-enylmethoxy)benzaldehyde
InChI:
InChI=1S/C15H16O2/c16-9-11-2-5-15(6-3-11)17-10-14-8-12-1-4-13(14)7-12/h1-6,9,12-14H,7-8,10H2
InChI Key:
LGWVOAFXHXLMAG-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)OCC1CC2CC1C=C2
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.115g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.291g/mol
Monoisotopic Mass:
228.115g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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