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Hexylbenzene

CAS No.:
1077-16-3
Catalog Number:
AG003QXH
Molecular Formula:
C12H18
Molecular Weight:
162.2713
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Purity
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Product Description
Catalog Number:
AG003QXH
Chemical Name:
Hexylbenzene
CAS Number:
1077-16-3
Molecular Formula:
C12H18
Molecular Weight:
162.2713
MDL Number:
MFCD00009526
IUPAC Name:
hexylbenzene
InChI:
InChI=1S/C12H18/c1-2-3-4-6-9-12-10-7-5-8-11-12/h5,7-8,10-11H,2-4,6,9H2,1H3
InChI Key:
LTEQMZWBSYACLV-UHFFFAOYSA-N
SMILES:
CCCCCCc1ccccc1
EC Number:
214-070-7
UNII:
8E3D1A2BZP
NSC Number:
86141
Properties
Complexity:
90.2  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.141g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.276g/mol
Monoisotopic Mass:
162.141g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5  
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Properties