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88947-01-7

88947-01-7 | 9-Oxabicyclo[6.2.0]dec-4-ene, 10,10-diphenyl-, (Z)-

CAS No: 88947-01-7 Catalog No: AG0047XX MDL No:

Product Description

Catalog Number:
AG0047XX
Chemical Name:
9-Oxabicyclo[6.2.0]dec-4-ene, 10,10-diphenyl-, (Z)-
CAS Number:
88947-01-7
Molecular Formula:
C21H22O
Molecular Weight:
290.3988
IUPAC Name:
10,10-diphenyl-9-oxabicyclo[6.2.0]dec-4-ene
InChI:
InChI=1S/C21H22O/c1-2-10-16-20-19(15-9-1)21(22-20,17-11-5-3-6-12-17)18-13-7-4-8-14-18/h1-8,11-14,19-20H,9-10,15-16H2
InChI Key:
DTSHRXYRPRCTNR-UHFFFAOYSA-N
SMILES:
C1=CCCC2C(CC1)C(O2)(c1ccccc1)c1ccccc1

Properties

Complexity:
369  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.167g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
290.406g/mol
Monoisotopic Mass:
290.167g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
1  
XLogP3:
5.1  

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