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Heptylcyclohexane - 99%, high purity , CAS No.5617-41-4

COA

Grade & Purity:

≥99%

Cas Number: 5617-41-4
Molecular Weight: 182.35
MDL number: MFCD00019404
PubChem CID: 21832
PubChem SID: 488182724

In stock

Item Number

H157211

Grouped product items
SKU	Size	Availability	Price	Qty
H157211-1ml	1ml	3	$52.90
H157211-5ml	5ml	1	$158.90

View related series

alkane (162) Non heterocyclic block (8163)

Basic Description

Synonyms	NSC102802 \| NSC-102802 \| 1-Cyclohexylheptane \| MFCD00019404 \| EINECS 227-041-9 \| FT-0635784 \| NSC 102802 \| Heptane, 1-cyclohexyl- \| n-Heptylcyclohexane \| DTXSID1058636 \| AS-47895 \| F16715 \| HEPTYLCYCLOHEXANE \| n-Heptyl cyclohexane \| H0442 \| MSTLSCNJAHAQNU
Specifications & Purity	≥99%
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	Not available
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	488182724
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488182724
IUPAC Name	heptylcyclohexane
INCHI	InChI=1S/C13H26/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h13H,2-12H2,1H3
InChIKey	MSTLSCNJAHAQNU-UHFFFAOYSA-N
Smiles	CCCCCCCC1CCCCC1
Isomeric SMILES	CCCCCCCC1CCCCC1
Molecular Weight	182.35
Reaxy-Rn	1901453
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1901453&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.

4 results found

Lot Number	Certificate Type	Date	Item
G2405232	Certificate of Analysis	Mar 23, 2024	H157211
G2405233	Certificate of Analysis	Mar 23, 2024	H157211
L22071029	Certificate of Analysis	Oct 18, 2022	H157211
L22071036	Certificate of Analysis	Oct 18, 2022	H157211

Chemical and Physical Properties

Refractive Index	1.44
Boil Point(°C)	244 °C
Molecular Weight	182.350 g/mol
XLogP3	6.800
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	6
Exact Mass	182.203 Da
Monoisotopic Mass	182.203 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	101.000
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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