2-Amino-4-(chloromethyl)thiazole - CAS 7250-84-2

Catalog:	BB034635
Product Name:	2-Amino-4-(chloromethyl)thiazole
CAS:	7250-84-2
Synonyms:	4-(chloromethyl)-2-thiazolamine; 4-(chloromethyl)-1,3-thiazol-2-amine

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	4-(chloromethyl)-1,3-thiazol-2-amine
Description:	2-Amino-4-(chloromethyl)thiazole (CAS# 7250-84-2) is a useful research chemical.
Molecular Weight:	148.61
Molecular Formula:	C4H5ClN2S
Canonical SMILES:	C1=C(N=C(S1)N)CCl
InChI:	InChI=1S/C4H5ClN2S/c5-1-3-2-8-4(6)7-3/h2H,1H2,(H2,6,7)
InChI Key:	QYKUGBMFPFOPNE-UHFFFAOYSA-N
Boiling Point:	299.7 °C at 760 mmHg
Density:	1.455 g/cm³
LogP:	2.04530

Publication Number	Title	Priority Date
WO-2020006210-A1	Pyridopyrimidine compounds and methods of their use	20180627
WO-2020006210-A9	Pyridopyrimidine compounds and methods of their use	20180627
US-2021261547-A1	Pyridopyrimidine compounds and methods of their use	20180627
AU-2017283790-B2	Substituted pyridines as inhibitors of DNMT1	20160613
CN-109563043-A	The substituted pyridine of inhibitor as DNMT1	20160613

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Related Functional Groups

Amines and Anilines

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	80.4
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	147.986197
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	147.986197
Rotatable Bond Count:	1
Topological Polar Surface Area:	67.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1