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142050-18-8 | Benzoic acid, 3,4,5-tris(decyloxy)-
CAS No: 142050-18-8 Catalog No: AG001HNC MDL No:
Product Description
Catalog Number:
AG001HNC
Chemical Name:
Benzoic acid, 3,4,5-tris(decyloxy)-
CAS Number:
142050-18-8
Molecular Formula:
C37H66O5
Molecular Weight:
590.9169
IUPAC Name:
3,4,5-tris-decoxybenzoic acid
InChI:
InChI=1S/C37H66O5/c1-4-7-10-13-16-19-22-25-28-40-34-31-33(37(38)39)32-35(41-29-26-23-20-17-14-11-8-5-2)36(34)42-30-27-24-21-18-15-12-9-6-3/h31-32H,4-30H2,1-3H3,(H,38,39)
InChI Key:
AKSBDBNMHPWNFY-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCOc1c(OCCCCCCCCCC)cc(cc1OCCCCCCCCCC)C(=O)O
Properties
Complexity:
551
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
590.491g/mol
Formal Charge:
0
Heavy Atom Count:
42
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
590.93g/mol
Monoisotopic Mass:
590.491g/mol
Rotatable Bond Count:
31
Topological Polar Surface Area:
65A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
14.9
Literature
| Title | Journal |
|---|---|
| Dispersion of single walled carbon nanotubes in organogels by incorporation into organogel fibers. | Journal of colloid and interface science 20101201 |
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