FACl - ≥99.5%(4 Times Purification) , CAS No.6313-33-3

CAS: 6313-33-3 Cat. No.: F492012 Formula: CH₄N₂·HCl Molecular Weight: 80.52 Beilstein Registry Number: 3906935 EC Number: 228-639-2

GRADE & PURITY ≥99.5%(4 Times Purification)

Synonyms

FORMAMIDINE, HYDROCHLORIDE | FT-0626527 | SB75370 | AKOS000260178 | Formimidamide hydrochloride | 2-hydroxy-4-methyl-3-nitro pyridine | FORMAMIDINE, MONOHYDROCHLORIDE | F0103 | formamidine HCl salt | NMVVJCLUYUWBSZ-UHFFFAOYSA-N | MFCD00012865 | A15719 | A

Storage

Protected from light,Room temperature,Argon charged

Shipped In

Normal

Overview

Application：

5-Methyl-4,6-dihydroxypyrimidine was synthesized from formamidine hydrochloride. N-Formimino-n-glutamate was synthesized from formamidine hydrochloride. Formamidine hydrochloride was used in the synthesis of imidazoleglycerol phosphate (IGP).

Specifications

Synonyms

FORMAMIDINE, HYDROCHLORIDE | FT-0626527 | SB75370 | AKOS000260178 | Formimidamide hydrochloride | 2-hydroxy-4-methyl-3-nitro pyridine | FORMAMIDINE, MONOHYDROCHLORIDE | F0103 | formamidine HCl salt | NMVVJCLUYUWBSZ-UHFFFAOYSA-N | MFCD00012865 | A15719 | A

Specifications & Purity

≥99.5%(4 Times Purification)

Storage

Protected from light,Room temperature,Argon charged

Shipped In

Normal

Purity

≥99.5%(4 Times Purification)

Names and Identifiers

Pubchem Sid

504765387

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504765387

Canonical Smiles

C(=N)N.Cl

IUPAC Name

methanimidamide;hydrochloride

InChIKey

NMVVJCLUYUWBSZ-UHFFFAOYSA-N

INCHI

1S/CH4N2.ClH/c2-1-3;/h1H,(H3,2,3);1H

Isomeric SMILES

C(=N)N.Cl

WGK Germany

3

Molecular Weight

80.52

Beilstein

3906935

Reaxy-Rn

3666426

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3666426&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Class Organonitrogen compounds
      • Subclass Amidines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Class: Organonitrogen compounds
• Subclass: Amidines
• Intermediate Tree Nodes: Not available
• Direct Parent: Carboxamidines
• Alternative Parents: Formamidines Carboximidamides Organopnictogen compounds Imines Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Formamidine - Carboximidamide - Carboxylic acid amidine - Organopnictogen compound - Hydrocarbon derivative - Hydrochloride - Imine - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as carboxamidines. These are carboxylic acid derivatives containing the amidine 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

Chemical and Physical Properties

• Solubility: Soluble in EtOH, DMF, DMSO, water et al
• Sensitivity: Moisture sensitive；air sensitive；light sensitive
• Melt Point(°C): 84-87°C
• Molecular Weight: 80.520 g/mol
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 80.0141 Da
• Monoisotopic Mass: 80.0141 Da
• Topological Polar Surface Area: 49.900 Ų
• Heavy Atom Count: 4
• Formal Charge: 0
• Complexity: 10.300
• 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

XLogP3