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100766-33-4 | Naphthalene, dihexyl- (6CI,7CI,9CI)
CAS No: 100766-33-4 Catalog No: AG0002UD MDL No:
Product Description
Catalog Number:
AG0002UD
Chemical Name:
Naphthalene, dihexyl- (6CI,7CI,9CI)
CAS Number:
100766-33-4
Molecular Formula:
C22H32
Molecular Weight:
296.4895
IUPAC Name:
1,2-dihexylnaphthalene
InChI:
InChI=1S/C22H32/c1-3-5-7-9-13-19-17-18-20-14-11-12-16-22(20)21(19)15-10-8-6-4-2/h11-12,14,16-18H,3-10,13,15H2,1-2H3
InChI Key:
VOMPMOXLDNRRRY-UHFFFAOYSA-N
SMILES:
CCCCCCc1ccc2c(c1CCCCCC)cccc2
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.25g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
296.498g/mol
Monoisotopic Mass:
296.25g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.1
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