trans-4-Methoxycyclohexanamine hydrochloride - ≥97% , CAS No.61367-41-7

CAS: 61367-41-7 Cat. No.: T634214 Summenformel: C₇H₁₅NO·HCl Molekulargewicht: 165.66 EG-Nummer: 805-099-1

GRADE & PURITY ≥97%

Synonyms

Cyclohexanamine, 4-methoxy-, hydrochloride, trans- | AKOS024464154 | 4-methoxycyclohexylamine hydrochloride | SB37936 | 4-Methoxycyclohexanamine hydrochloride | J-640198 | MFCD18207785 | (1r,4r)-4-methoxycyclohexanamine hydrochloride | SY205172 | DTXSID70

Storage

Protected from light,Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonyme

Cyclohexanamine, 4-methoxy-, hydrochloride, trans- | AKOS024464154 | 4-methoxycyclohexylamine hydrochloride | SB37936 | 4-Methoxycyclohexanamine hydrochloride | J-640198 | MFCD18207785 | (1r,4r)-4-methoxycyclohexanamine hydrochloride | SY205172 | DTXSID70

Spezifikationen & Reinheit

≥97%

Storage

Protected from light,Room temperature,Argon charged

Verschickt in

Normal

Reinheit

≥97%

Namen und Kennungen

• Pubchem Sid: 528770604
• Kanonisches Lächeln: N[C@H]1CC[C@H](OC)CC1.Cl
• IUPAC Name: 4-methoxycyclohexan-1-amine;hydrochloride
• InChIKey: DUVKXMNYICFZCS-UHFFFAOYSA-N
• INCHI: 1S/C7H15NO.ClH/c1-9-7-4-2-6(8)3-5-7;/h6-7H,2-5,8H2,1H3;1H
• Isomere SMILES: COC1CCC(CC1)N.Cl
• Alternative CAS-Nummer: 5460-27-5,61367-41-7
• NSC-Nummer: 25101
• Molekulargewicht: 165.66
• Reaxy-Rn: 13646243
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=13646243&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Klasse: Organonitrogen compounds
• Subclass: Cyclohexylamines
• Intermediate Tree Nodes: Not available
• Direct Parent: Cyclohexylamines
• Alternative Parents: Dialkyl ethers Organopnictogen compounds Monoalkylamines Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Cyclohexylamine - Ether - Dialkyl ether - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Hydrochloride - Primary amine - Organooxygen compound - Primary aliphatic amine - Amine - Aliphatic homomonocyclic compound
• Beschreibung: 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

Chemische und physikalische Eigenschaften

• Molekulargewicht: 165.660 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 165.092 Da
• Monoisotopic Mass: 165.092 Da
• Topological Polar Surface Area: 35.300 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 77.000
• 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: 2

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