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77550-10-8 | 1,3,5-Trioxane,2,4,6-tris(phenylmethyl)-
CAS No: 77550-10-8 Catalog No: AG005H2S MDL No:
Product Description
Catalog Number:
AG005H2S
Chemical Name:
1,3,5-Trioxane,2,4,6-tris(phenylmethyl)-
CAS Number:
77550-10-8
Molecular Formula:
C24H24O3
Molecular Weight:
360.4456
IUPAC Name:
2,4,6-tribenzyl-1,3,5-trioxane
InChI:
InChI=1S/C24H24O3/c1-4-10-19(11-5-1)16-22-25-23(17-20-12-6-2-7-13-20)27-24(26-22)18-21-14-8-3-9-15-21/h1-15,22-24H,16-18H2
InChI Key:
ZHTQEDBVQSVWEN-UHFFFAOYSA-N
SMILES:
O1C(OC(OC1Cc1ccccc1)Cc1ccccc1)Cc1ccccc1
EC Number:
278-723-8
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
360.173g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
360.453g/mol
Monoisotopic Mass:
360.173g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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