2-Amino-4-(3-chlorophenyl)thiazole - CAS 90533-23-6

Catalog:	BB039877
Product Name:	2-Amino-4-(3-chlorophenyl)thiazole
CAS:	90533-23-6
Synonyms:	4-(3-chlorophenyl)-2-thiazolamine; 4-(3-chlorophenyl)-1,3-thiazol-2-amine

Technical Data

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Computed Properties

IUPAC Name:	4-(3-chlorophenyl)-1,3-thiazol-2-amine
Description:	2-Amino-4-(3-chlorophenyl)thiazole (CAS# 90533-23-6) is a useful research chemical.
Molecular Weight:	210.68
Molecular Formula:	C9H7ClN2S
Canonical SMILES:	C1=CC(=CC(=C1)Cl)C2=CSC(=N2)N
InChI:	InChI=1S/C9H7ClN2S/c10-7-3-1-2-6(4-7)8-5-13-9(11)12-8/h1-5H,(H2,11,12)
InChI Key:	QSEDBGULKWHVNE-UHFFFAOYSA-N
MDL:	MFCD02664012
LogP:	3.62690

Publication Number	Title	Priority Date
CN-111116575-A	5-fluoro-2, 4-pyrimidinediamine compound and preparation and application thereof	20191218
CN-111116575-B	5-fluoro-2, 4-pyrimidinediamine compound and preparation and application thereof	20191218
CN-110845437-A	Method for preparing 2-aminothiazole compound	20191113
EP-3556756-A1	Substituted propanamides as inhibitors of nucleases	20180417
WO-2019201867-A1	Substituted propanamides as inhibitors of nucleases	20180417

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	179
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	210.0018471
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	210.0018471
Rotatable Bond Count:	1
Topological Polar Surface Area:	67.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.9