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Key Documents

268887

Sigma-Aldrich

2-Isopropylaniline

97%

Synonym(s):

o-Aminocumene

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About This Item

Linear Formula:
(CH3)2CHC6H4NH2
CAS Number:
Molecular Weight:
135.21
Beilstein:
636283
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

vapor pressure

0.05 mmHg ( 20 °C)

Quality Level

Assay

97%

form

liquid

refractive index

n20/D 1.548 (lit.)

bp

112-113 °C/18 mmHg (lit.)

density

0.955 g/mL at 25 °C (lit.)

SMILES string

CC(C)c1ccccc1N

InChI

1S/C9H13N/c1-7(2)8-5-3-4-6-9(8)10/h3-7H,10H2,1-2H3

InChI key

YKOLZVXSPGIIBJ-UHFFFAOYSA-N

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General description

The reactions of 1,1′-bis(hydroxymethyl)ferrocene with 2-isopropylaniline, in the presence of a catalyst [RuCl2(PPh3)3], was studied.

Application

2-Isopropylaniline was used in the synthesis of a colorless amine-coordinated zinc complex.

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Hazard Classifications

Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

204.8 °F - closed cup

Flash Point(C)

96 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Dongzhen Li et al.
Organic & biomolecular chemistry, 8(8), 1816-1820 (2010-05-08)
Zn(OTf)(2) acts as an excellent catalyst precursor for addition of various amine N-H bonds to carbodiimides under an atmosphere of air, offering a convenient synthesis of substituted guanidines with high functional-group tolerance. A Zn-N amido species is shown to act
Further Investigation on Preparation, Structure and Electrochemical Properties of N-Alkyl-and N-Aryl-2-aza-[3]-ferrocenophanes.
Sakano T, et al.
Bulletin of the Chemical Society of Japan, 74(11), 2059-2065 (2001)
Junbin Ji et al.
Applied microbiology and biotechnology, 103(15), 6333-6344 (2019-05-24)
The residues of aniline and its derivatives are serious environment pollutants. Aniline dioxygenase (AD) derived from aerobic bacteria catalyzes the conversion of aniline to catechol, which has potential use in the bioremediation of aromatic amines and biorefining process. AD contains

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