2-Amino-4H,5H,6H-cyclopenta[d][1,3]thiazol-6-one - CAS 1026710-03-1

Catalog:	BB054660
Product Name:	2-Amino-4H,5H,6H-cyclopenta[d][1,3]thiazol-6-one
CAS:	1026710-03-1
Synonyms:	2-Amino-4,5-dihydro-6H-cyclopenta[d]thiazol-6-one; 2-Amino-4H-cyclopenta[d]thiazol-6(5H)-one; 6H-Cyclopentathiazol-6-one, 2-amino-4,5-dihydro-; 2-Amino-4,5-dihydro-cyclopentathiazol-6-one

Technical Data

Safety and Hazards

Computed Properties

IUPAC Name:	2-amino-4,5-dihydrocyclopenta[d][1,3]thiazol-6-one
Molecular Weight:	154.19
Molecular Formula:	C6H6N2OS
Canonical SMILES:	C1CC(=O)C2=C1N=C(S2)N
InChI:	InChI=1S/C6H6N2OS/c7-6-8-3-1-2-4(9)5(3)10-6/h1-2H2,(H2,7,8)
InChI Key:	WWCOWASLMPTQDE-UHFFFAOYSA-N
Boiling Point:	359.0±11.0°C at 760 mmHg
Purity:	≥95%
Density:	1.5±0.1 g/cm3

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Related Functional Groups

Amines and Anilines

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1,1,2,2-Tetrafluoro-N,N-dimethylethanamine
[1431965-90-0]
1-Cyclopentyl-5-methylpyrazol-3-amine hydrochloride
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2-(4-Pyrazolyl)ethylamine

Oxazole/Thiazole

[859473-05-5]
N-(3,4-Dichlorophenyl)-1,3-thiazol-2-amine
[1401934-53-9]
2-Amino-4-(3,4-dimethoxyphenyl)-5-phenylthiazole
[3973-08-8]
4-Thiazolecarboxylic acid
[262857-90-9]
(R)-4-(4-Aminobenzyl)-2-oxazolidinone
[56355-79-4]
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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; 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, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	173
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	154.02008399
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	154.02008399
Rotatable Bond Count:	0
Topological Polar Surface Area:	84.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.7