Formamidine hydrochloride - CAS 6313-33-3
Catalog: |
BB032015 |
Product Name: |
Formamidine hydrochloride |
CAS: |
6313-33-3 |
Synonyms: |
methanimidamide;hydrochloride |
IUPAC Name: | methanimidamide;hydrochloride |
Description: | Formamidine hydrochloride (CAS# 6313-33-3) is an intermediate used to prepare Formiminoglycine which is used in biological studies for the metabolism by purinolytic clostridia. It was also used in the synthesis of 5-methyl-4,6-dihydroxypyrimidine. |
Molecular Weight: | 80.52 |
Molecular Formula: | CH5ClN2 |
Canonical SMILES: | C(=N)N.Cl |
InChI: | InChI=1S/CH4N2.ClH/c2-1-3;/h1H,(H3,2,3);1H |
InChI Key: | NMVVJCLUYUWBSZ-UHFFFAOYSA-N |
Boiling Point: | 46.3 ℃ at 760 mmHg |
Melting Point: | 85 ℃ |
Solubility: | Soluble in Ethanol;very slightly soluble in Ether |
Appearance: | White to almost white powder to crystal |
Storage: | Store under inert gas |
MDL: | MFCD00012865 |
LogP: | 1.15420 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
23030245 | 20121025 | Thermal fluctuations and infrared spectra of the formamide-formamidine complex | The journal of physical chemistry. A |
22704656 | 20120715 | Analogs of N'-hydroxy-N-(4H,5H-naphtho[1,2-d]thiazol-2-yl)methanimidamide inhibit Mycobacterium tuberculosis methionine aminopeptidases | Bioorganic & medicinal chemistry |
22519972 | 20120401 | Nitrogen incorporation in CH(4)-N(2) photochemical aerosol produced by far ultraviolet irradiation | Astrobiology |
22039964 | 20111202 | Direct condensation of sulfonamide and formamide: NaI-catalyzed synthesis of N-sulfonyl formamidine using TBHP as oxidant | Organic letters |
21870787 | 20111007 | Alkoxyamine-derived formamidines: configurational control and molecular folding | Organic letters |
Complexity: | 10.3 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 80.0141259 |
Formal Charge: | 0 |
Heavy Atom Count: | 4 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 80.0141259 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 49.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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