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79418-72-7 | Benzaldehyde, 2-fluoro-5-methoxy-4-(phenylmethoxy)-
CAS No: 79418-72-7 Catalog No: AG00520I MDL No:
Product Description
Catalog Number:
AG00520I
Chemical Name:
Benzaldehyde, 2-fluoro-5-methoxy-4-(phenylmethoxy)-
CAS Number:
79418-72-7
Molecular Formula:
C15H13FO3
Molecular Weight:
260.2603
IUPAC Name:
2-fluoro-5-methoxy-4-phenylmethoxybenzaldehyde
InChI:
InChI=1S/C15H13FO3/c1-18-14-7-12(9-17)13(16)8-15(14)19-10-11-5-3-2-4-6-11/h2-9H,10H2,1H3
InChI Key:
OLVWVOPLCFKINL-UHFFFAOYSA-N
SMILES:
COc1cc(C=O)c(cc1OCc1ccccc1)F
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.085g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.264g/mol
Monoisotopic Mass:
260.085g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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