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Dicyclohexylamine - analytical standard,>99.5%(GC), high purity , CAS No.101-83-7
Basic Description
Synonyms
UNII-1A93RJW924 | FT-0624742 | BIDD:ER0258 | Dicyclohexylamine, 99% | STR04129 | Tox21_111044 | N,N-DICYCLOHXYL-AMINE | Dicyclohexylamine [UN2565] [Corrosive] | EINECS 202-980-7 | InChI=1/C12H23N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h11-13H,1-10H | NCGC00
Specifications & Purity
analytical standard, ≥99.5%(GC)
Shipped In
Normal
Grade
analytical standard
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organic nitrogen compounds
Class
Organonitrogen compounds
Subclass
Cyclohexylamines
Intermediate Tree Nodes
Not available
Direct Parent
Cyclohexylamines
Alternative Parents
Dialkylamines Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aliphatic homomonocyclic compounds
Substituents
Cyclohexylamine - Secondary amine - Secondary aliphatic amine - Organopnictogen compound - Hydrocarbon derivative - 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
primary aliphatic amine
Data sources
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.
Associated Targets(Human)
Associated Targets(non-human)
Mechanisms of Action
Mechanism of Action
Action Type
target ID
Target Name
Target Type
Target Organism
Binding Site Name
References
Names and Identifiers
IUPAC Name
N-cyclohexylcyclohexanamine
INCHI
InChI=1S/C12H23N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h11-13H,1-10H2
InChIKey
XBPCUCUWBYBCDP-UHFFFAOYSA-N
Smiles
C1CCC(CC1)NC2CCCCC2
Isomeric SMILES
C1CCC(CC1)NC2CCCCC2
WGK Germany
2
RTECS
HY4025000
UN Number
2565
Packing Group
III
Molecular Weight
181.32
Beilstein
605923
Reaxy-Rn
605923
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=605923&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Solubility
Slightly soluble in water, miscible with ethanol, ether, and benzene.
Refractive Index
1.484
Flash Point(°F)
204.8℉
Flash Point(°C)
96°C
Boil Point(°C)
117-120°C
Melt Point(°C)
-2°C
Molecular Weight
181.320 g/mol
XLogP3
3.400
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
1
Rotatable Bond Count
2
Exact Mass
181.183 Da
Monoisotopic Mass
181.183 Da
Topological Polar Surface Area
12.000 Ų
Heavy Atom Count
13
Formal Charge
0
Complexity
116.000
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
Citations of This Product
1.
Zhenhua Tian, Jianzhong Ma, Qiwu Liu, Hui Zhang.
(2023)
Preparation and application of novel amphoteric acrylic retanning agents to improve dye absorption. Reaction Chemistry & Engineering,
8
(3):
(645-655).
2.
Ruijuan Duan, Meiling Qi.
(2022)
Separation performance of pentiptycene-functionalized triblock copolymers towards the isomers of xylenes, phenols and anilines and the complex components in essential oil. JOURNAL OF CHROMATOGRAPHY A,
1669
(462927).
3.
Xue Xiong, Meiling Qi.
(2020)
A novel column fabrication approach for capillary gas chromatography via a cross-linked organogel network with high stability and inertness. NEW JOURNAL OF CHEMISTRY,
44
(25):
(10621-10627).
4.
Xue Xiong, Meiling Qi.
(2020)
Adenine-functionalized polypropylene glycol: A novel stationary phase for gas chromatography offering good inertness for acids and bases combined with a unique selectivity. JOURNAL OF CHROMATOGRAPHY A,
1612
(460627).
5.
Zhongyue Huang, Huijie Gu, Xiaofan Yin, Long Gao, Kunxi Zhang, Yiming Zhang, Jun Xu, Liang Wu, Jingbo Yin, Lei Cui.
(2019)
Bone regeneration using injectable poly (γ-benzyl-L-glutamate) microspheres loaded with adipose-derived stem cells in a mouse femoral non-union model. American Journal of Translational Research,
11
(5):
( 2641–2656).
6.
Jianjun Fang, Qi Yong, Kunxi Zhang, Wentao Sun, Shifeng Yan, Lei Cui, Jingbo Yin.
(2015)
Novel injectable porous poly(γ-benzyl-L-glutamate) microspheres for cartilage tissue engineering: preparation and evaluation. Journal of Materials Chemistry B,
3
(6):
(1020-1031).
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6 Citations
F2411313