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2221-51-4 | Benzaldehyde,2-(5-formyl-2-methoxyphenoxy)-4,5-dimethoxy-
CAS No: 2221-51-4 Catalog No: AG006ZFS MDL No:
Product Description
Catalog Number:
AG006ZFS
Chemical Name:
Benzaldehyde,2-(5-formyl-2-methoxyphenoxy)-4,5-dimethoxy-
CAS Number:
2221-51-4
Molecular Formula:
C17H16O6
Molecular Weight:
316.3053
IUPAC Name:
2-(5-formyl-2-methoxyphenoxy)-4,5-dimethoxybenzaldehyde
InChI:
InChI=1S/C17H16O6/c1-20-13-5-4-11(9-18)6-17(13)23-14-8-16(22-3)15(21-2)7-12(14)10-19/h4-10H,1-3H3
InChI Key:
YYGSGVZGXFWVMM-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)Oc1cc(OC)c(cc1C=O)OC)OC
NSC Number:
157095
Properties
Complexity:
387
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.095g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
316.309g/mol
Monoisotopic Mass:
316.095g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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