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(1-Ethylheptyl)benzene,Benzene, (1-ethylheptyl)-, nonan-3-ylbenzene,Ca

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摘 要:(1-Ethylheptyl)benzene,Benzene, (1-ethylheptyl)-, nonan-3-ylbenzene,Canonical SMILES: CCCCCCC(CC)C1=CC=CC=C1,InChI: InChI=1/C15H24/c1-3-5-6-8-11-14(4-2)15-12-9-7-10-13-15/h7,9-10,12-14H,,3-6,8,11H2,1-2H3,Molecular Weight204.35106 [g/mol]Molecular For
[Synonyms]
(1-Ethylheptyl)benzene
Benzene, (1-ethylheptyl)-

[Structure]
(1-Ethylheptyl)benzene,Benzene, (1-ethylheptyl)-, nonan-3-ylbenzene,Ca

[ Properties Computed from Structure]
Molecular Weight204.35106 [g/mol]
Molecular FormulaC15H24
XLogP6.8
H-Bond Donor0
H-Bond Acceptor0
Rotatable Bond Count7
Exact Mass204.187801
MonoIsotopic Mass204.187801
Topological Polar Surface Area0
Heavy Atom Count15
Formal Charge0
Complexity133
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count1
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1

[ Descriptors Computed from Structure]
IUPAC Name: nonan-3-ylbenzene
Canonical SMILES: CCCCCCC(CC)C1=CC=CC=C1
InChI: InChI=1/C15H24/c1-3-5-6-8-11-14(4-2)15-12-9-7-10-13-15/h7,9-10,12-14H,
3-6,8,11H2,1-2H3

 
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