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123632-87-1

123632-87-1 | 1,5-Dioxa-9-thiaspiro[5.5]undecane-3-methanol, 3-ethyl-8,10-diphenyl-

CAS No: 123632-87-1 Catalog No: AG000KX0 MDL No:

Product Description

Catalog Number:
AG000KX0
Chemical Name:
1,5-Dioxa-9-thiaspiro[5.5]undecane-3-methanol, 3-ethyl-8,10-diphenyl-
CAS Number:
123632-87-1
Molecular Formula:
C23H28O3S
Molecular Weight:
384.5316
IUPAC Name:
(3-ethyl-8,10-diphenyl-1,5-dioxa-9-thiaspiro[5.5]undecan-3-yl)methanol
InChI:
InChI=1S/C23H28O3S/c1-2-22(15-24)16-25-23(26-17-22)13-20(18-9-5-3-6-10-18)27-21(14-23)19-11-7-4-8-12-19/h3-12,20-21,24H,2,13-17H2,1H3
InChI Key:
GCOUMBYSRDLPSS-UHFFFAOYSA-N
SMILES:
CCC1(CO)COC2(OC1)CC(SC(C2)c1ccccc1)c1ccccc1

Properties

Complexity:
434  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
384.176g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
384.534g/mol
Monoisotopic Mass:
384.176g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
64A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  

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