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17954-12-0 | Benzaldehyde, 2,2'-[1,3-propanediylbis(oxy)]bis-
CAS No: 17954-12-0 Catalog No: AG00273F MDL No:
Product Description
Catalog Number:
AG00273F
Chemical Name:
Benzaldehyde, 2,2'-[1,3-propanediylbis(oxy)]bis-
CAS Number:
17954-12-0
Molecular Formula:
C17H16O4
Molecular Weight:
284.3065
IUPAC Name:
2-[3-(2-formylphenoxy)propoxy]benzaldehyde
InChI:
InChI=1S/C17H16O4/c18-12-14-6-1-3-8-16(14)20-10-5-11-21-17-9-4-2-7-15(17)13-19/h1-4,6-9,12-13H,5,10-11H2
InChI Key:
QZBZYBGWXUQJMT-UHFFFAOYSA-N
SMILES:
O=Cc1ccccc1OCCCOc1ccccc1C=O
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.105g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.311g/mol
Monoisotopic Mass:
284.105g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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