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87829-12-7 | Naphthalene, 1-(1-cycloocten-1-yl)-
CAS No: 87829-12-7 Catalog No: AG004ENV MDL No:
Product Description
Catalog Number:
AG004ENV
Chemical Name:
Naphthalene, 1-(1-cycloocten-1-yl)-
CAS Number:
87829-12-7
Molecular Formula:
C18H20
Molecular Weight:
236.3514
IUPAC Name:
1-(cycloocten-1-yl)naphthalene
InChI:
InChI=1S/C18H20/c1-2-4-9-15(10-5-3-1)18-14-8-12-16-11-6-7-13-17(16)18/h6-9,11-14H,1-5,10H2
InChI Key:
FQRKUCWGDOGZGY-UHFFFAOYSA-N
SMILES:
C1CCCC(=CCC1)c1cccc2c1cccc2
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.157g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.358g/mol
Monoisotopic Mass:
236.157g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
6
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