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1-Hexyl-2-methylimidazole

CAT: 1552-KI-0011-HP-2500Size: 2.5 KgDry Ice: NoHazardous: No
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CAT#:1552-KI-0011-HP-2500Size:2.5 Kg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
82410-68-2
Product Name Alternative
KI 0011, 2.5 kg
Purity
>98%
Molecular Formula
C10H18N2
Molecular Weight
166.26
IUPAC Name
1-Hexyl-2-methylimidazole

Chemical Information

1-Hexyl-2-methylimidazol
CAS Number82410-68-2
PubChem CID20482080
IUPAC Name1-hexyl-2-methylimidazole
Molecular FormulaC10H18N2
Molecular Weight166.26
XLogP2.7
Topological Polar Surface Area17.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count5
Heavy Atom Count12
Formal Charge0
Complexity114
SMILES
CCCCCCN1C=CN=C1C
InChI
InChI=1S/C10H18N2/c1-3-4-5-6-8-12-9-7-11-10(12)2/h7,9H,3-6,8H2,1-2H3
InChIKey
YFSQYUBYYKHCQV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Hexyl-2-methylimidazol
CAS: 82410-68-2
CID: 20482080
Formula: C10H18N2
MW: 166.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight166.26
XLogP32.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count5
Exact Mass166.146998583
Monoisotopic Mass166.146998583
Topological Polar Surface Area17.8 Ų
Heavy Atom Count12
Formal Charge0
Complexity114
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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