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199190-12-0 | Benzaldehyde, 3,3'-[1,2-ethanediylbis(oxy)]bis[4-methoxy- (9CI)
CAS No: 199190-12-0 Catalog No: AG002BYK MDL No:
Product Description
Catalog Number:
AG002BYK
Chemical Name:
Benzaldehyde, 3,3'-[1,2-ethanediylbis(oxy)]bis[4-methoxy- (9CI)
CAS Number:
199190-12-0
Molecular Formula:
C18H18O6
Molecular Weight:
330.3319
IUPAC Name:
3-[2-(5-formyl-2-methoxyphenoxy)ethoxy]-4-methoxybenzaldehyde
InChI:
InChI=1S/C18H18O6/c1-21-15-5-3-13(11-19)9-17(15)23-7-8-24-18-10-14(12-20)4-6-16(18)22-2/h3-6,9-12H,7-8H2,1-2H3
InChI Key:
VWHQATFWYRBDDN-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1OCCOc1cc(C=O)ccc1OC)C=O
NSC Number:
244648
Properties
Complexity:
352
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.11g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
330.336g/mol
Monoisotopic Mass:
330.11g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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