2-Isopropylimidazole

CAT: 0024-sc-230443Size: 100 gDry Ice: NoHazardous: No

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CAT#:0024-sc-230443Size:100 g

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CAS Number

36947-68-9

Chemical Information

1H-Imidazole, 2-(1-methylethyl)-

CAS Number	36947-68-9
PubChem CID	123457
IUPAC Name	2-propan-2-yl-1H-imidazole
Molecular Formula	C6H10N2
Molecular Weight	110.16
XLogP	1.2
Topological Polar Surface Area	28.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	8
Formal Charge	0
Complexity	70

SMILES

CC(C)C1=NC=CN1

InChI

InChI=1S/C6H10N2/c1-5(2)6-7-3-4-8-6/h3-5H,1-2H3,(H,7,8)

InChIKey

FUOZJYASZOSONT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 36947-68-9

CID: 123457

Formula: C6H10N2

MW: 110.16

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	110.16
XLogP3	1.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	110.084398327
Monoisotopic Mass	110.084398327
Topological Polar Surface Area	28.7 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	70.9
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
sc-460941	1-Isopropylimidazole
sc-209283	2,2,2-Trifluoroethyl 2,5-Bis (2,2,2-trifluoroethoxy) benzoate
sc-209282	2,2,2-Trifluoroethyl 2-Hydroxy-5- (2,2,2-trifluoroethoxy) benzoate
sc-474673	2-[2- (2,2,2-Trifluoroethoxy) phenoxy]-ethanol
sc-343301A	2,2,2-trifluoroethyl 2-fluorophenylcarbamate
sc-320473	2- (2,2,2-trifluoroethoxy) benzaldehyde
sc-343303A	2,2,2-trifluoroethyl 2-methoxyphenylcarbamate
sc-356285	2- (2,2,2-Trifluoroethoxy) nitrobenzene
sc-475858	2- (2,2,2-Trifluoroethoxy) phenol
sc-506736	2'-Amino-2,2,2-trifluoroacetophenone

Catalog	Name
OR924662-01	2-Isopropylimidazole
228807-01	1-Isopropylimidazole
270043-01	2-Chloro-1-N-isopropylimidazole
280938-01	1-Isopropylimidazole discontinued. See 228807
230078-01	2-Chloro-1-N-isopropylimidazole ≥95% (GC)
PC1003049-01	2,2,2-Trifluoroethyl 2,2,2-trichloroacetate
H 038-001	2'- , 2''-, 2''', 2'''', 2''''', 2''''''- Hexadeoxy- 2'-, 2'', 2''', 2'''', 2''''', 2''''''- hexafluoro- cyclic hexaadenosine monophosphate (2',2'',2''',2'''',2''''',2''''''-Hexa-F-c-hexadAMP / cFA6), sodium salt
PC32719-01	2,2,2,2'-Tetrafluoroacetophenone
OR1009873-01	2,2,2,2-Ethylenedinitrilotetraethanol
290342-01	2,2,2-Trifluoroethyl 2,5-bis (2,2,2-trifluoroethoxy) benzoate