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1-(1,1-Dimethylethoxy)-2-Methylpropane

CAT: 0572-TRC-D679533-2.5GSize: 2.5 gDry Ice: NoHazardous: Yes
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CAT#:0572-TRC-D679533-2.5GSize:2.5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
33021-02-2
Synonyms
1-(1,1-Dimethylethoxy)-2-methylpropane; 1-tert-Butoxy-2-methylpropane; Isobutyl tert-Butyl Ether; tert-Butyl Isobutyl Ether;
Hazard Statement
Highly flammable liquid and vapour; UN number: UN3271; Packing Group: II
Smiles
CC(C)COC(C)(C)C
Molecular Formula
C8H18O
Molecular Weight
130.23
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Isopropyl tert-butyl ether
CAS Number33021-02-2
PubChem CID118384
IUPAC Name2-methyl-1-[(2-methylpropan-2-yl)oxy]propane
Molecular FormulaC8H18O
Molecular Weight130.23
XLogP2.4
Topological Polar Surface Area9.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Heavy Atom Count9
Formal Charge0
Complexity69
SMILES
CC(C)COC(C)(C)C
InChI
InChI=1S/C8H18O/c1-7(2)6-9-8(3,4)5/h7H,6H2,1-5H3
InChIKey
UPOMCDPCTBJJDA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Isopropyl tert-butyl ether
CAS: 33021-02-2
CID: 118384
Formula: C8H18O
MW: 130.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight130.23
XLogP32.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Exact Mass130.135765193
Monoisotopic Mass130.135765193
Topological Polar Surface Area9.2 Ų
Heavy Atom Count9
Formal Charge0
Complexity69.1
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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Alternative Products

CatalogName
AR-B02338-011- (1,1-Dimethylethoxy) -2-Methylpropane
TYD-02655-011,1-Diethoxy-2-methylpropane
OR1046529-011,1-Dimethoxy-2-methylpropane
sc-4748871,1,2-Trichloro-2-methylpropane
1591292- (1,1-Dimethylethoxy) ethanol
264039-011-Bromo-2-methylpropane
sc-2375171-Chloro-2-methylpropane
280709-011-Iodo-2-methylpropane
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