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Isopropylcyclohexane - >99.0%(GC), high purity , CAS No.696-29-7

COA

Grade & Purity:

≥99%(GC)

Cas Number: 696-29-7
Molecular Weight: 126.24
Beilstein Registry Number: 1900470
MDL number: MFCD00001480
PubChem CID: 12763
PubChem SID: 488181734

In stock

Item Number

I157551

Grouped product items
SKU	Size	Availability	Price
I157551-5ml	5ml	10	$19.90
I157551-25ml	25ml	7	$72.90
I157551-100ml	100ml	3	$205.90

View related series

alkane (162) Non heterocyclic block (8163)

Basic Description

Synonyms	Q63408583 \| LS-13699 \| (1-methylethyl)-Cyclohexane \| A836573 \| Cyclohexane, (1-methylethyl)- \| CHEBI:187116 \| Hexahydrocumene \| DTXSID2061012 \| LMFA11000629 \| Cyclohexane, isopropyl- \| 1-methylethyl-cyclohexane \| MFCD00001480 \| NSC73963 \| NSC-73963 \| Isop
Specifications & Purity	≥99%(GC)
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Hydrocarbons
  - Class Saturated hydrocarbons
    - Subclass Cycloalkanes

Kingdom	Organic compounds
Superclass	Hydrocarbons
Class	Saturated hydrocarbons
Subclass	Cycloalkanes
Intermediate Tree Nodes	Not available
Direct Parent	Cycloalkanes
Alternative Parents	Not available
Molecular Framework	Aliphatic homomonocyclic compounds
Substituents	Cycloalkane - Aliphatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as cycloalkanes. These are saturated monocyclic hydrocarbons (with or without side chains).
External Descriptors	Hydrocarbons
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

Pubchem Sid	488181734
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488181734
IUPAC Name	propan-2-ylcyclohexane
INCHI	InChI=1S/C9H18/c1-8(2)9-6-4-3-5-7-9/h8-9H,3-7H2,1-2H3
InChIKey	GWESVXSMPKAFAS-UHFFFAOYSA-N
Smiles	CC(C)C1CCCCC1
Isomeric SMILES	CC(C)C1CCCCC1
WGK Germany	1
UN Number	3295
Packing Group	I
Molecular Weight	126.24
Beilstein	1900470
Reaxy-Rn	1900472
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1900472&ln=

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

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

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

12 results found

Lot Number	Certificate Type	Date	Item
C2512700	Certificate of Analysis	Mar 04, 2025	I157551
C2512697	Certificate of Analysis	Mar 04, 2025	I157551
C2512691	Certificate of Analysis	Mar 04, 2025	I157551
J2428583	Certificate of Analysis	Jul 04, 2024	I157551
J2428590	Certificate of Analysis	Jul 04, 2024	I157551
J2428591	Certificate of Analysis	Jul 04, 2024	I157551
L2205243	Certificate of Analysis	Nov 15, 2022	I157551
L2205246	Certificate of Analysis	Nov 15, 2022	I157551
L2205247	Certificate of Analysis	Nov 15, 2022	I157551
L2205231	Certificate of Analysis	Nov 15, 2022	I157551
D2315470	Certificate of Analysis	Nov 15, 2022	I157551
D2315463	Certificate of Analysis	Dec 13, 2021	I157551

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Chemical and Physical Properties

Refractive Index	1.441
Flash Point(°F)	95 °F
Flash Point(°C)	35°C
Boil Point(°C)	155 °C
Molecular Weight	126.240 g/mol
XLogP3	4.300
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Exact Mass	126.141 Da
Monoisotopic Mass	126.141 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	68.100
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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