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2,6-Diisopropylaniline

CAT: 0572-TRC-D459940-100GSize: 100 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-D459940-100GSize:100 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
24544-04-5
Synonyms
2,6-Diisopropyl- aniline; 2,6-Bis(1-methylethyl)aniline; 2,6-Bis(1-methylethyl)benzenamine; 2,6-Diisopropylphenylamine; N-(2,6-Diisopropylphenyl)amine
Hazard Statement
May be harmful if swallowed.
Purity
>95% (HPLC)
Smiles
CC(C)c1cccc(C(C)C)c1N
Molecular Formula
C12H19N
Molecular Weight
177.29
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Diisopropylaniline
CAS Number24544-04-5
PubChem CID32484
IUPAC Name2,6-di(propan-2-yl)aniline
Molecular FormulaC12H19N
Molecular Weight177.29
XLogP3.2
Topological Polar Surface Area26
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count13
Formal Charge0
Complexity135
SMILES
CC(C)C1=C(C(=CC=C1)C(C)C)N
InChI
InChI=1S/C12H19N/c1-8(2)10-6-5-7-11(9(3)4)12(10)13/h5-9H,13H2,1-4H3
InChIKey
WKBALTUBRZPIPZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Diisopropylaniline
CAS: 24544-04-5
CID: 32484
Formula: C12H19N
MW: 177.29
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight177.29
XLogP33.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass177.151749610
Monoisotopic Mass177.151749610
Topological Polar Surface Area26 Ų
Heavy Atom Count13
Formal Charge0
Complexity135
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
270654-012,6-Diisopropylaniline
PC1007562-014-Fluoro-2,6-diisopropylaniline
OR1099151-014-iodo-2,6-diisopropylaniline
OR1011453-014-Bromo-2,6-Diisopropylaniline
OR80024-014-Chloro-2,6-diisopropylaniline
abx186518-01N,N'-Methanediylidenebis(2,6-diisopropylaniline)
sc-3525484,4'-Methylenebis- (2,6-diisopropylaniline)
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