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113416-62-9 | 1H-Indene, 1-octyl-
CAS No: 113416-62-9 Catalog No: AG0008HO MDL No:
Product Description
Catalog Number:
AG0008HO
Chemical Name:
1H-Indene, 1-octyl-
CAS Number:
113416-62-9
Molecular Formula:
C17H24
Molecular Weight:
228.3725
IUPAC Name:
1-octyl-1H-indene
InChI:
InChI=1S/C17H24/c1-2-3-4-5-6-7-10-15-13-14-16-11-8-9-12-17(15)16/h8-9,11-15H,2-7,10H2,1H3
InChI Key:
SMJMRBVOQAZKSW-UHFFFAOYSA-N
SMILES:
CCCCCCCCC1C=Cc2c1cccc2
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.188g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.379g/mol
Monoisotopic Mass:
228.188g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
6.8
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