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4-Isopropylaniline - analytical standard,>99.7%(GC), high purity , CAS No.99-88-7

COA

Grade & Purity:

analytical standard

≥99.7%(GC)

Cas Number: 99-88-7
Molecular Weight: 135.21
Beilstein Registry Number: 1930544
EC Number: 202-797-2
MDL number: MFCD00007900
PubChem CID: 7464

In stock

Item Number

I106863

Grouped product items
SKU	Size	Availability	Price
I106863-250mg	250mg	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$69.90
I106863-1g	1g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$241.90
I106863-5g	5g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$1,030.90
I106863-25g	25g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$4,464.90
I106863-100g	100g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$13,734.90
I106863-250g	250g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$27,467.90

Basic Description

Synonyms	4-ISOPROPYLANILINE \| 99-88-7 \| Cumidine \| 4-Aminocumene \| p-Isopropylaniline \| p-Cumidine \| 4-Amino-1-isopropylbenzene \| 4-(Propan-2-Yl)Aniline \| PARA-ISOPROPYLANILINE \| 4-propan-2-ylaniline \| Benzenamine, 4-(1-methylethyl)- \| Cumene, p-amino- \| Aniline, p-isopropyl- \| 4-(2-propyl
Specifications & Purity	analytical standard, ≥99.7%(GC)
Shipped In	Normal
Grade	analytical standard

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Cumenes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Cumenes
Intermediate Tree Nodes	Not available
Direct Parent	Cumenes
Alternative Parents	Phenylpropanes Aniline and substituted anilines Primary amines Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Phenylpropane - Cumene - Aniline or substituted anilines - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Amine - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as cumenes. These are aromatic compounds containing a prop-2-ylbenzene moiety.
External Descriptors	substituted aniline
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	4-propan-2-ylaniline
INCHI	InChI=1S/C9H13N/c1-7(2)8-3-5-9(10)6-4-8/h3-7H,10H2,1-2H3
InChIKey	LRTFPLFDLJYEKT-UHFFFAOYSA-N
Smiles	CC(C)C1=CC=C(C=C1)N
Isomeric SMILES	CC(C)C1=CC=C(C=C1)N
WGK Germany	2
Molecular Weight	135.21
Beilstein	1930544
Reaxy-Rn	1930544
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1930544&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

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7 results found

Lot Number	Certificate Type	Date	Item
H2209413	Certificate of Analysis	May 14, 2024	I106863
H2209415	Certificate of Analysis	May 14, 2024	I106863
H2209462	Certificate of Analysis	May 14, 2024	I106863
H2209416	Certificate of Analysis	May 14, 2024	I106863
H2209414	Certificate of Analysis	May 14, 2024	I106863
D1918115	Certificate of Analysis	Nov 14, 2022	I106863
H2209365	Certificate of Analysis	Jun 20, 2022	I106863

Chemical and Physical Properties

Refractive Index	1.54
Flash Point(°F)	197.6 °F
Flash Point(°C)	92 °C
Boil Point(°C)	224°C
Molecular Weight	135.210 g/mol
XLogP3	2.200
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	135.105 Da
Monoisotopic Mass	135.105 Da
Topological Polar Surface Area	26.000 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	90.900
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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