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Home > Aldehydes > 143785-69-7
143785-69-7 | Benzaldehyde, 3,4-bis(octadecyloxy)-
CAS No: 143785-69-7 Catalog No: AG007JH0 MDL No:
Product Description
Catalog Number:
AG007JH0
Chemical Name:
Benzaldehyde, 3,4-bis(octadecyloxy)-
CAS Number:
143785-69-7
Molecular Formula:
C43H78O3
Molecular Weight:
643.0776
IUPAC Name:
3,4-dioctadecoxybenzaldehyde
InChI:
InChI=1S/C43H78O3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37-45-42-36-35-41(40-44)39-43(42)46-38-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-36,39-40H,3-34,37-38H2,1-2H3
InChI Key:
SIWXMBQGZBIAOA-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCCOc1cc(C=O)ccc1OCCCCCCCCCCCCCCCCCC
Properties
Complexity:
593
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
642.595g/mol
Formal Charge:
0
Heavy Atom Count:
46
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
643.094g/mol
Monoisotopic Mass:
642.595g/mol
Rotatable Bond Count:
37
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
19
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