2-Amino-5-fluorothiazole hydrochloride - CAS 745053-64-9

Catalog:	BB035100
Product Name:	2-Amino-5-fluorothiazole hydrochloride
CAS:	745053-64-9
Synonyms:	5-fluoro-1,3-thiazol-2-amine;hydrochloride

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	5-fluoro-1,3-thiazol-2-amine;hydrochloride
Description:	5-Fluorothiazol-2-amine Hydrochloride can be used as anti-tumor agents.
Molecular Weight:	154.59
Molecular Formula:	C3H3FN2S · HCl
Canonical SMILES:	C1=C(SC(=N1)N)F.Cl
InChI:	InChI=1S/C3H3FN2S.ClH/c4-2-1-6-3(5)7-2;/h1H,(H2,5,6);1H
InChI Key:	HUXNGTYNEWXYDM-UHFFFAOYSA-N
Boiling Point:	221.8 °C at 760 mmHg
Purity:	97.0 %
MDL:	MFCD09056854
LogP:	2.24760

Publication Number	Title	Priority Date
AU-2018238079-A1	Novel pyridone carboxylic acid derivative or salt thereof	20170324
CA-3061877-A1	Novel pyridone carboxylic acid derivative or salt thereof	20170324
EP-3604305-A1	Novel pyridone carboxylic acid derivative or salt thereof	20170324
JP-WO2018174266-A1	Novel pyridonecarboxylic acid derivative or salt thereof	20170324
US-2020062752-A1	Novel pyridone carboxylic acid derivative or salt thereof	20170324

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	70
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	153.9767752
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	153.9767752
Rotatable Bond Count:	0
Topological Polar Surface Area:	67.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0