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827596-23-6 | Benzaldehyde, 2,4-bis[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]-
CAS No: 827596-23-6 Catalog No: AG005766 MDL No:
Product Description
Catalog Number:
AG005766
Chemical Name:
Benzaldehyde, 2,4-bis[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]-
CAS Number:
827596-23-6
Molecular Formula:
C19H30O9
Molecular Weight:
402.4361
IUPAC Name:
2,4-bis[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]benzaldehyde
InChI:
InChI=1S/C19H30O9/c20-3-5-23-7-9-25-11-13-27-18-2-1-17(16-22)19(15-18)28-14-12-26-10-8-24-6-4-21/h1-2,15-16,20-21H,3-14H2
InChI Key:
SQPHGUFNOOHGDC-UHFFFAOYSA-N
SMILES:
OCCOCCOCCOc1ccc(c(c1)OCCOCCOCCO)C=O
Properties
Complexity:
356
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
402.189g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
402.44g/mol
Monoisotopic Mass:
402.189g/mol
Rotatable Bond Count:
19
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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