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863870-95-5 | Benzofuran,4-heptyl-2-phenyl-
CAS No: 863870-95-5 Catalog No: AG004RHL MDL No:
Product Description
Catalog Number:
AG004RHL
Chemical Name:
Benzofuran,4-heptyl-2-phenyl-
CAS Number:
863870-95-5
Molecular Formula:
C21H24O
Molecular Weight:
292.4147
IUPAC Name:
4-heptyl-2-phenyl-1-benzofuran
InChI:
InChI=1S/C21H24O/c1-2-3-4-5-7-11-17-14-10-15-20-19(17)16-21(22-20)18-12-8-6-9-13-18/h6,8-10,12-16H,2-5,7,11H2,1H3
InChI Key:
QWKWVDGYNKZUKP-UHFFFAOYSA-N
SMILES:
CCCCCCCc1cccc2c1cc(o2)c1ccccc1
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.183g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
292.422g/mol
Monoisotopic Mass:
292.183g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
13.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.5
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