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88339-56-4 | Benzaldehyde, 2,4-dimethyl-6-(phenylmethoxy)-
CAS No: 88339-56-4 Catalog No: AG0089MU MDL No:
Product Description
Catalog Number:
AG0089MU
Chemical Name:
Benzaldehyde, 2,4-dimethyl-6-(phenylmethoxy)-
CAS Number:
88339-56-4
Molecular Formula:
C16H16O2
Molecular Weight:
240.2970
IUPAC Name:
2,4-dimethyl-6-phenylmethoxybenzaldehyde
InChI:
InChI=1S/C16H16O2/c1-12-8-13(2)15(10-17)16(9-12)18-11-14-6-4-3-5-7-14/h3-10H,11H2,1-2H3
InChI Key:
YNNMEBXCOPITKO-UHFFFAOYSA-N
SMILES:
O=Cc1c(OCc2ccccc2)cc(cc1C)C
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.115g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.302g/mol
Monoisotopic Mass:
240.115g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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