Formamidine hydrochloride - CAS 6313-33-3

Catalog:	BB032015
Product Name:	Formamidine hydrochloride
CAS:	6313-33-3
Synonyms:	Formimidamide hydrochloride; Methanimidamide, monohydrochloride; Formamidinium chloride

Catalog	Size	Price	Stock	Quantity
BB032015	1 kg	$599	In stock

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Technical Data

IUPAC Name:	methanimidamide;hydrochloride
Description:	Formamidine hydrochloride 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 imidazoleglycerol phosphate (IGP).
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
Melting Point:	84-87 °C(lit.)
Purity:	98%
Solubility:	Soluble in Ethanol;very slightly soluble in Ether
Appearance:	Off-White Solid
Storage:	Store at RT
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