2-(thietan-3-yl)ethan-1-amine - CAS 1352242-97-7

Catalog:	BB008100
Product Name:	2-(thietan-3-yl)ethan-1-amine
CAS:	1352242-97-7
Synonyms:	2-(3-thietanyl)ethanamine; 2-(thietan-3-yl)ethanamine

Technical Data

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Computed Properties

IUPAC Name:	2-(thietan-3-yl)ethanamine
Description:	2-(thietan-3-yl)ethan-1-amine (CAS# 1352242-97-7) is a useful research chemical.
Molecular Weight:	117.21
Molecular Formula:	C5H11NS
Canonical SMILES:	C1C(CS1)CCN
InChI:	InChI=1S/C5H11NS/c6-2-1-5-3-7-4-5/h5H,1-4,6H2
InChI Key:	BEXVRWKWMWYBDY-UHFFFAOYSA-N
LogP:	1.39850

Publication Number	Title	Priority Date
WO-2014096381-A1	(hetero) arylacrylamides for the control of ectoparasites	20121220
AU-2012298448-A1	Isoxazoline derivatives as insecticidal compounds	20110825
EP-2747570-A1	Isoxazoline derivatives as insecticidal compounds	20110825
EP-2747570-B1	Isoxazoline derivatives as insecticidal compounds	20110825
EP-2748154-A1	Process for the preparation of thietane derivatives	20110825

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Related Functional Groups

Oxetane/Thietane

[1394319-79-9]
Ethyl 2-(1,1-dioxidothietan-3-ylidene)acetate
[1864252-66-3]
N-(2,2-dimethylthietan-3-yl)-2,2-difluoropropanamide
[1379811-98-9]
3-(3-Bromophenyl)oxetan-3-ol
[1393441-68-3]
tert-Butyl ((3-(hydroxymethyl)oxetan-3-yl)methyl)carbamate
[2091328-57-1]
(S)-Oxetane-2-methanamine
[1850206-88-0]
N-(1-fluoropropan-2-yl)thietan-3-amine

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GHS Hazard Statement:	H227 (100%): Combustible liquid [Warning Flammable liquids]; H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/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:	P210, P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P362+P364, P363, P370+P378, P403, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	52
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	117.06122053
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	117.06122053
Rotatable Bond Count:	2
Topological Polar Surface Area:	51.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.3