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30309-99-0

30309-99-0 | 4H-1,3-Benzodioxin, 2,4,4-triphenyl-

CAS No: 30309-99-0 Catalog No: AG002ZLQ MDL No:

Product Description

Catalog Number:
AG002ZLQ
Chemical Name:
4H-1,3-Benzodioxin, 2,4,4-triphenyl-
CAS Number:
30309-99-0
Molecular Formula:
C26H20O2
Molecular Weight:
364.4358
IUPAC Name:
2,4,4-triphenyl-1,3-benzodioxine
InChI:
InChI=1S/C26H20O2/c1-4-12-20(13-5-1)25-27-24-19-11-10-18-23(24)26(28-25,21-14-6-2-7-15-21)22-16-8-3-9-17-22/h1-19,25H
InChI Key:
WAVYJDXSAFBUPB-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C1Oc2ccccc2C(O1)(c1ccccc1)c1ccccc1

Properties

Complexity:
467  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
364.146g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
364.444g/mol
Monoisotopic Mass:
364.146g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
6.1  

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