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88875-77-8 | 2-Octadecanol, 1-(triphenylmethoxy)-
CAS No: 88875-77-8 Catalog No: AG0049JW MDL No:
Product Description
Catalog Number:
AG0049JW
Chemical Name:
2-Octadecanol, 1-(triphenylmethoxy)-
CAS Number:
88875-77-8
Molecular Formula:
C37H52O2
Molecular Weight:
528.8076
IUPAC Name:
1-trityloxyoctadecan-2-ol
InChI:
InChI=1S/C37H52O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-24-31-36(38)32-39-37(33-25-18-15-19-26-33,34-27-20-16-21-28-34)35-29-22-17-23-30-35/h15-23,25-30,36,38H,2-14,24,31-32H2,1H3
InChI Key:
IKQZTDXMTBYIAV-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCC(COC(c1ccccc1)(c1ccccc1)c1ccccc1)O
Properties
Complexity:
510
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
528.397g/mol
Formal Charge:
0
Heavy Atom Count:
39
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
528.821g/mol
Monoisotopic Mass:
528.397g/mol
Rotatable Bond Count:
21
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
12.4
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