1H-1,2,4-Triazole-1-carboxamidine Hydrochloride - CAS 19503-26-5

Name: 1H-1,2,4-Triazole-1-carboxamidine Hydrochloride
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB015099
Product Name:	1H-1,2,4-Triazole-1-carboxamidine Hydrochloride
CAS:	19503-26-5
Synonyms:	1,2,4-triazole-1-carboximidamide;hydrochloride; 1,2,4-triazole-1-carboximidamide;hydrochloride

Technical Data

IUPAC Name:	1,2,4-triazole-1-carboximidamide;hydrochloride
Description:	1H-1,2,4-Triazole-1-carboxamidine Hydrochloride (CAS# 19503-26-5) is an intermediate used in the synthesis of peramivir (P285500), a neuraminidase inhibitor developed as an antiviral agent for the treatment of influenza.
Molecular Weight:	147.57
Molecular Formula:	C3H6ClN5
Canonical SMILES:	C1=NN(C=N1)C(=N)N.Cl
InChI:	InChI=1S/C3H5N5.ClH/c4-3(5)8-2-6-1-7-8;/h1-2H,(H3,4,5);1H
InChI Key:	JDDXNENZFOOLTP-UHFFFAOYSA-N
Boiling Point:	294 °C at 760 mmHg
MDL:	MFCD03095468
LogP:	0.62170

GHS Hazard Statement:	H301 (95.12%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P264, P270, P280, P301+P310, P305+P351+P338, P321, P330, P337+P313, P405, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
WO-2021024075-A1	Articles containing a crosslinked guanidinyl-containing polymer and uses thereof	20190807
WO-2020243506-A1	Removable film-forming gel compositions featuring adhesion promoters	20190531
TW-202106761-A	Phenolic functionalized polyimides and compositions thereof	20190426
CN-108997171-B	Synthetic method of 3+2 closed ring	20180621
US-2021188855-A1	Compounds	20180518

Complexity:	99.8
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	147.0311729
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	147.0311729
Rotatable Bond Count:	1
Topological Polar Surface Area:	80.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0