1-Amino-1-(hydroxyethyl)cyclohexane - ≥96% , CAS No.4313-56-8

CAS: 4313-56-8 Cat. No.: A170341 Formule: C₇H₁₅NO Poids moléculaire: 129.2 Numéro CE: 685-682-3

GRADE & PURITY ≥96%

Synonyms

MFCD12198034 | PS-5650 | ACyHM | EN300-40941 | 1-Amino-1-(hydroxymethyl)cyclohexane | (1-aminocyclohexyl)methanol | (1-Amino-cyclohexyl)-methanol | (1-aminocyclohexyl)-methanol | (1-Aminocyclohex-1-yl)methanol | AT12680 | SY295098 | 1-Amino-1-hydroxymethy

Storage

Room temperature

Shipped In

Normal

Specifications

Synonymes

MFCD12198034 | PS-5650 | ACyHM | EN300-40941 | 1-Amino-1-(hydroxymethyl)cyclohexane | (1-aminocyclohexyl)methanol | (1-Amino-cyclohexyl)-methanol | (1-aminocyclohexyl)-methanol | (1-Aminocyclohex-1-yl)methanol | AT12680 | SY295098 | 1-Amino-1-hydroxymethy

Spécifications et pureté

≥96%

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Pureté

≥96%

Noms et identifiants

Pubchem Sid

488189687

Sourires canoniques

C1CCC(CC1)(CO)N

IUPAC Name

(1-aminocyclohexyl)methanol

InChIKey

VDPLLINNMXFNQX-UHFFFAOYSA-N

INCHI

1S/C7H15NO/c8-7(6-9)4-2-1-3-5-7/h9H,1-6,8H2

Isomères SMILES

C1CCC(CC1)(CO)N

WGK Allemagne

3

Poids moléculaire

129.2

Reaxy-Rn

2801691

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2801691&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Classe: Organonitrogen compounds
• Subclass: Cyclohexylamines
• Intermediate Tree Nodes: Not available
• Direct Parent: Cyclohexylamines
• Alternative Parents: 1,2-aminoalcohols Primary alcohols Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Cyclohexylamine - 1,2-aminoalcohol - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Primary alcohol - Organooxygen compound - Primary aliphatic amine - Amine - Alcohol - 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

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

Propriétés chimiques et physiques

• Point de fusion (°C): 34-38°C
• Poids moléculaire: 129.199 g/mol
• XLogP3: 0.200
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 129.115 Da
• Monoisotopic Mass: 129.115 Da
• Topological Polar Surface Area: 46.300 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 86.900
• 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

Foire aux questions

What is the purity of this product?

This product is supplied at ≥96% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 4313-56-8, the molecular formula is C7H15NO, and the molecular weight is 129.2 g/mol. InChIKey VDPLLINNMXFNQX-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.