1-Hexylimidazole

CAT: 1552-KI-0005-HP-1000Size: 1 KgDry Ice: NoHazardous: No

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CAT#:1552-KI-0005-HP-1000Size:1 Kg

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CAS Number

33529-01-0

Product Name Alternative

KI 0005, 1 kg

Purity

>98%

Molecular Formula

C9H16N2

Molecular Weight

152.24

IUPAC Name

1-Hexylimidazole

Chemical Information

1H-Imidazole, 1-hexyl-

CAS Number	33529-01-0
PubChem CID	3015660
IUPAC Name	1-hexylimidazole
Molecular Formula	C9H16N2
Molecular Weight	152.24
XLogP	2.3
Topological Polar Surface Area	17.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	5
Heavy Atom Count	11
Formal Charge	0
Complexity	93

SMILES

CCCCCCN1C=CN=C1

InChI

InChI=1S/C9H16N2/c1-2-3-4-5-7-11-8-6-10-9-11/h6,8-9H,2-5,7H2,1H3

InChIKey

KGWVFQAPOGAVRF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 33529-01-0

CID: 3015660

Formula: C9H16N2

MW: 152.24

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	152.24
XLogP3	2.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	5
Exact Mass	152.131348519
Monoisotopic Mass	152.131348519
Topological Polar Surface Area	17.8 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	93.6
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
IL-0145-HP-0250	1-Methyl-1-propylpyrrolidinium bromide
IL-0145-HP-0025	1-Methyl-1-propylpyrrolidinium bromide
IL-0090-HP-0050	1-Methyl-1-propylpiperidinium bromide
IL-0318-HP-1000	1-Butyl-1-methylpyrrolidinium tricyanomethanide
IL-0318-HP-0050	1-Butyl-1-methylpyrrolidinium tricyanomethanide
IL-0249-HP-0250	1-Methyl-1-propylpyrrolidinium dicyanamide
IL-0249-HP-0100	1-Methyl-1-propylpyrrolidinium dicyanamide
IL-0175-HP-5000	1-Methyl-1-propylpiperidinium triflate
IL-0175-HP-1000	1-Methyl-1-propylpiperidinium triflate
IL-0174-HP-BULK	1-Butyl-1-methylpiperidinium triflate

Catalog	Name
OR922266-01	1-Hexylimidazole
OF59775-01	1,1,1,1,1-Kestoheptaose
N2864-5.1	1,1,1,1-Kestohexaose
112040	1,1,1,1-Kestohexose
410417-01	1,1,1-Trichloromethanesulfonic Acid 1,1'-Anhydride
IFA69273-01	1-Iodobicyclo[1.1.1]pentane
OR312388	1-Phenylbicyclo[1.1.1]pentane
GTR19217879-01	AMPK-α1β1γ1 activator 1