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1-Decyl-2-methylimidazole

CAT: 1552-KI-0013-HP-2500Size: 2.5 KgDry Ice: NoHazardous: No
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CAT#:1552-KI-0013-HP-2500Size:2.5 Kg
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CAS Number
42032-30-4
Product Name Alternative
KI 0013, 2.5 kg
Purity
>98%
Molecular Formula
C14H26N2
Molecular Weight
222.37
IUPAC Name
1-Decyl-2-methylimidazole

Chemical Information

1-Decyl-2-methyl-1H-imidazole
CAS Number42032-30-4
PubChem CID2775924
IUPAC Name1-decyl-2-methylimidazole
Molecular FormulaC14H26N2
Molecular Weight222.37
XLogP4.8
Topological Polar Surface Area17.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count9
Heavy Atom Count16
Formal Charge0
Complexity159
SMILES
CCCCCCCCCCN1C=CN=C1C
InChI
InChI=1S/C14H26N2/c1-3-4-5-6-7-8-9-10-12-16-13-11-15-14(16)2/h11,13H,3-10,12H2,1-2H3
InChIKey
BKFRZOZNMWIFLH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Decyl-2-methyl-1H-imidazole
CAS: 42032-30-4
CID: 2775924
Formula: C14H26N2
MW: 222.37
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight222.37
XLogP34.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count9
Exact Mass222.209598838
Monoisotopic Mass222.209598838
Topological Polar Surface Area17.8 Ų
Heavy Atom Count16
Formal Charge0
Complexity159
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