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669773-98-2

669773-98-2 | 1,5,7,11-Tetraoxaspiro[5.5]undecane-3,9-dimethanol, 3,9-didecyl-

CAS No: 669773-98-2 Catalog No: AG005RVR MDL No:

Product Description

Catalog Number:
AG005RVR
Chemical Name:
1,5,7,11-Tetraoxaspiro[5.5]undecane-3,9-dimethanol, 3,9-didecyl-
CAS Number:
669773-98-2
Molecular Formula:
C29H56O6
Molecular Weight:
500.7513
IUPAC Name:
[3,9-didecyl-3-(hydroxymethyl)-1,5,7,11-tetraoxaspiro[5.5]undecan-9-yl]methanol
InChI:
InChI=1S/C29H56O6/c1-3-5-7-9-11-13-15-17-19-27(21-30)23-32-29(33-24-27)34-25-28(22-31,26-35-29)20-18-16-14-12-10-8-6-4-2/h30-31H,3-26H2,1-2H3
InChI Key:
RRMDRGURLMGMET-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCC1(CO)COC2(OC1)OCC(CO2)(CO)CCCCCCCCCC

Properties

Complexity:
460  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
500.408g/mol
Formal Charge:
0
Heavy Atom Count:
35  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
500.761g/mol
Monoisotopic Mass:
500.408g/mol
Rotatable Bond Count:
20  
Topological Polar Surface Area:
77.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.7  

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