Formamidine Disulfide Dihydrochloride - ≥98%(N) , CAS No.14807-75-1

CAS: 14807-75-1 Cat. No.: F156624 Molecular Weight: 223.13 EC Number: 238-876-3 PubChem CID: 24802135

GRADE & PURITY ≥98%(N)

Synonyms

Thioperoxydicarbonimidic diamide ([(H2N)C(NH)]2S2), hydrochloride (1:2) | AKOS025401731 | AMY39308 | LS-12943 | M5L3DK8SAM | Dithioformamidine dihydrochloride | Thioperoxydicarbonimidic diamide ([(H2N)C(NH)]2S2), dihydrochloride | Dithiodiformamide Dihydr

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

Thioperoxydicarbonimidic diamide ([(H2N)C(NH)]2S2), hydrochloride (1:2) | AKOS025401731 | AMY39308 | LS-12943 | M5L3DK8SAM | Dithioformamidine dihydrochloride | Thioperoxydicarbonimidic diamide ([(H2N)C(NH)]2S2), dihydrochloride | Dithiodiformamide Dihydr

Specifications & Purity

≥98%(N)

Storage

Room temperature

Shipped In

Normal

Purity

≥98%(N)

Names and Identifiers

• Pubchem Sid: 504769835
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504769835
• Canonical Smiles: C(=N)(N)SSC(=N)N.Cl.Cl
• IUPAC Name: carbamimidoylsulfanyl carbamimidothioate;dihydrochloride
• InChIKey: BFJQSCVWXZOXGK-UHFFFAOYSA-N
• INCHI: 1S/C2H6N4S2.2ClH/c3-1(4)7-8-2(5)6;;/h(H3,3,4)(H3,5,6);2*1H
• Isomeric SMILES: C(=N)(N)SSC(=N)N.Cl.Cl
• RTECS: LQ4570000
• PubChem CID: 24802135
• Molecular Weight: 223.13
• Reaxy-Rn: 3913478

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organosulfur compounds
    • Class Organic disulfides

• Kingdom: Organic compounds
• Superclass: Organosulfur compounds
• Class: Organic disulfides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organic disulfides
• Alternative Parents: Sulfenyl compounds Carboximidamides Organopnictogen compounds Organic chloride salts Imines Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organic disulfide - Sulfenyl compound - Carboximidamide - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organic chloride salt - Organic salt - Organonitrogen compound - Imine - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as organic disulfides. These are organosulfur compounds with the general formula RSSR' (R,R' = alkyl, aryl).
• 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

• Molecular Weight: 223.200 g/mol
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 221.957 Da
• Monoisotopic Mass: 221.957 Da
• Topological Polar Surface Area: 150.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 96.600
• 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: 3

XLogP3

References

1. Peng Lin-Ling, Zhou Wei-Fang, Chen Min, Li Li-Jun, Liu Yu, Zhou Cong-Shan, Xie Jun, Tang Ke-Wen.  (2023)  Novel disulfide functionalized nitrogen-rich covalent organic polymer for efficient and recyclable adsorption of Au(III).  JOURNAL OF POLYMER RESEARCH,  30  (11): (1-10).  [PMID:] [10.1007/s10965-023-03796-2]