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1,4-Cyclohexanediamine (cis- and trans- mixture) - >97.0%, high purity , CAS No.3114-70-3

2 Citations

COA

Grade & Purity:

≥97%

Cas Number: 3114-70-3
Molecular Weight: 114.19
MDL number: MFCD00035862
PubChem CID: 18374

In stock

Item Number

C153643

Grouped product items
SKU	Size	Availability	Price
C153643-5ml	5ml	2	$19.90
C153643-25ml	25ml	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$57.90
C153643-100ml	100ml	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$208.90

View related series

Imide (271) Six membered carbocyclic compound (243)

Basic Description

Synonyms	SCHEMBL31990 \| 1,4-trans diaminocyclohexane \| J-009489 \| I11239 \| 1,4-Cyclohexanediamine, trans- \| trans-1.4-diaminocyclohexane \| BS-15836 \| SCHEMBL8230252 \| AM100652 \| (1r,4r)-cyclohexane-1,4-diamine \| (1s,4s)-cyclohexane-1,4-diamine \| 4-aminocyclohexyla
Specifications & Purity	≥97%
Storage Temp	Argon charged
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic nitrogen compounds
  - Class Organonitrogen compounds
    - Subclass Cyclohexylamines

Kingdom	Organic compounds
Superclass	Organic nitrogen compounds
Class	Organonitrogen compounds
Subclass	Cyclohexylamines
Intermediate Tree Nodes	Not available
Direct Parent	Cyclohexylamines
Alternative Parents	Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives
Molecular Framework	Aliphatic homomonocyclic compounds
Substituents	Cyclohexylamine - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Primary aliphatic amine - Amine - Aliphatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as cyclohexylamines. These are organic compounds containing a cyclohexylamine moiety, which consist of a cyclohexane ring attached to an amine group.
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

IUPAC Name	cyclohexane-1,4-diamine
INCHI	InChI=1S/C6H14N2/c7-5-1-2-6(8)4-3-5/h5-6H,1-4,7-8H2
InChIKey	VKIRRGRTJUUZHS-UHFFFAOYSA-N
Smiles	C1CC(CCC1N)N
Isomeric SMILES	C1CC(CCC1N)N
RTECS	GU8750500
Molecular Weight	114.19
Reaxy-Rn	1919871
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1919871&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.

6 results found

Lot Number	Certificate Type	Date	Item
F2210788	Certificate of Analysis	Mar 20, 2024	C153643
F2210784	Certificate of Analysis	Mar 20, 2024	C153643
K2108257	Certificate of Analysis	Aug 11, 2023	C153643
K2108263	Certificate of Analysis	Aug 11, 2023	C153643
K2108233	Certificate of Analysis	Aug 11, 2023	C153643
D1912101	Certificate of Analysis	Dec 07, 2022	C153643

Chemical and Physical Properties

Sensitivity	Air sensitive
Boil Point(°C)	197 °C
Molecular Weight	114.190 g/mol
XLogP3	-0.300
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	114.116 Da
Monoisotopic Mass	114.116 Da
Topological Polar Surface Area	52.000 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	54.900
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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