4,4'-metilenbis(ciclohexilamina) (mezcla de isómeros) - ≥97% , CAS No.1761-71-3

CAS: 1761-71-3 Cat. No.: M158600 Peso molecular: 210.37 Número EC: 217-168-8

GRADE & PURITY ≥97%

Synonyms

M0699 | (trans(trans))-4,4'-Methylenebis(cyclohexylamine) | DTXSID40891277 | Q27279773 | DTXSID0024921 | SCHEMBL1201897 | Bis(p-aminocyclohexyl)methane | DI(P-AMINOCYCLOHEXYL)METHANE | MFCD00001496 | (cis,cis)-4,4'-Methylenebis[cyclohexanamine] | 4,4'-Met

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinónimos

M0699 | (trans(trans))-4, 4'-Methylenebis(cyclohexylamine) | DTXSID40891277 | Q27279773 | DTXSID0024921 | SCHEMBL1201897 | Bis(p-aminocyclohexyl)methane | DI(P-AMINOCYCLOHEXYL)METHANE | MFCD00001496 | (cis, cis)-4, 4'-Methylenebis[cyclohexanamine] | 4, 4'-Met

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Argon charged, Room temperature

Enviado en

Normal

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 488182159
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488182159
• Sonrisas canónicas: C1CC(CCC1CC2CCC(CC2)N)N
• IUPAC Name: 4-[(4-aminocyclohexyl)methyl]cyclohexan-1-amine
• InChIKey: DZIHTWJGPDVSGE-UHFFFAOYSA-N
• INCHI: 1S/C13H26N2/c14-12-5-1-10(2-6-12)9-11-3-7-13(15)8-4-11/h10-13H,1-9,14-15H2
• Isómeros SMILES: C1CC(CCC1CC2CCC(CC2)N)N
• RTECS: GX1530000
• Número ONU: 3259
• Grupo de embalaje: I
• Peso molecular: 210.37
• Reaxy-Rn: 2079179
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2079179&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Clase Organonitrogen compounds
      • Subclass Cyclohexylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Clase: 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
• Descripción: 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

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.

DOI: 10.1186/s13321-016-0174-y

Objetivos asociados (humanos)

VDR Tclin Vitamin D receptor (26531 Activities)

Discover Target: VDR

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

THRB Tclin Thyroid hormone receptor beta-1 (7926 Activities)

Discover Target: THRB

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Lymphoblastoid cell (5959 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

APEX1 Tchem DNA-(apurinic or apyrimidinic site) lyase (38016 Activities)

Discover Target: APEX1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Insoluble in water
• Sensibilidad: air sensitive
• Punto de ebullición (°C): 126°C
• Punto de fusión (°C): 40 °C
• Peso molecular: 210.360 g/mol
• XLogP3: 1.900
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 210.21 Da
• Monoisotopic Mass: 210.21 Da
• Topological Polar Surface Area: 52.000 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 157.000
• 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

Referencias

1. Xuejie Wang, Chongwen Yu, Jiaqi Sun, Chenzhong Mu, Yujie Song.  (2023)  A novel isocyanate-free strategy towards preparation of polyurea by a ring-opening reaction.  Polymer Chemistry,  14  (41): (4719-4725).  [PMID:] [10.1039/D3PY00926B]

2. He Dan, Zhu Dandan, Zheng Zhen, Wang Xinling.  (2023)  Preparation of photosensitive resin based on poly (trimethylene ether glycol) for 3D printing.  JOURNAL OF POLYMER RESEARCH,  30  (8): (1-9).  [PMID:] [10.1007/s10965-023-03680-z]

3. Yazhou Tian, Meng Ke, Xiuli Wang, Guangdong Wu, Junying Zhang, Jue Cheng.  (2021)  A resveratrol-based epoxy resin with ultrahigh Tg and good processability.  EUROPEAN POLYMER JOURNAL,      [PMID:] [10.1016/j.eurpolymj.2021.110282]

4. Yunjian Wu, Hui Lin, Yiran Hu, Fujin Cai, Xiaoxing Zhang.  (2024)  Electrical and Degradation Properties of Epoxy Insulating Materials Based on Schiff Bases.  ACS Applied Polymer Materials,      [PMID:] [10.1021/acsapm.3c02110]

5. Li Yan Mei, Zhang Ze Ping, Rong Min Zhi, Zhang Ming Qiu.  (2022)  Tailored modular assembly derived self-healing polythioureas with largely tunable properties covering plastics, elastomers and fibers.  Nature Communications,  13  (1): (1-10).  [PMID:35551199] [10.1038/s41467-022-30364-x]

6. Wentao Chen, Ke Zhang, Shuai Wang, Chunhai Chen, Xiaogang Zhao, Hongwei Zhou, Daming Wang.  (2025)  Construction of “rigid-and-flexible” interphase by waterborne carboxylated polyimide sizing agent for interfacial enhancement of carbon fiber/poly ether ether ketone (CF/PEEK) composites.  COMPOSITES PART B-ENGINEERING,      [PMID:] [10.1016/j.compositesb.2025.112388]

7. Xiaohua Li, Miaomiao Hu, Qiang Wang, Ming Liu, Jianwei Wang, Yongxu Xie, Jintang Guo.  (2025)  Preparation of boron nitride reinforced epoxy phase change microcapsules for the cementing of natural gas hydrate layers.  CONSTRUCTION AND BUILDING MATERIALS,      [PMID:] [10.1016/j.conbuildmat.2025.142450]

8. Jian Long, Qiang Gao, Haojun Fan, Jun Xiang.  (2025)  Low-Temperature Foaming Approach for Solvent-free Polyurethane Coating Based on Dual Carbon Strategy.  ACS Sustainable Chemistry & Engineering,      [PMID:] [10.1021/acssuschemeng.5c00449]

9. Jun Li, Qin Lei, Xiaodong Wang, Boming Zhang, Jinrui Ye.  (2025)  Superior adaptability of bicontinuous structural electrolytes with excellent ionic conductivity and surpassing mechanical properties.  JOURNAL OF MATERIALS SCIENCE & TECHNOLOGY,      [PMID:] [10.1016/j.jmst.2025.04.057]

10. Xiaohua Li, Xiujian Xia, Susu Xing, Yongxu Xie, Rongyao Chen, Miaomiao Hu, Jintang Guo.  (2025)  Silica-reinforced epoxy shell phase change microcapsules for thermal regulation and mechanical enhancement of deep-water cementing composites.  CONSTRUCTION AND BUILDING MATERIALS,      [PMID:] [10.1016/j.conbuildmat.2025.144042]

11. Qiang Gao, Weiwei Fan, Zhonghui Wang, Haojun Fan, Jun Xiang.  (2026)  Porous solvent-free polyurethane coating with 3D conductive network for efficient electrothermal/photothermal conversion and intelligent temperature sensing.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2026.175320]