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2-(1,3-Thiazol-4-yl)ethan-1-amine Dihydrochloride

2-(1,3-Thiazol-4-yl)ethan-1-amine Dihydrochloride - CAS 7771-09-7

Catalog:	BB071175
Product Name:	2-(1,3-Thiazol-4-yl)ethan-1-amine Dihydrochloride
CAS:	7771-09-7
Synonyms:	2-(1,3-thiazol-4-yl)ethan-1-amine dihydrochloride; 4-(AMINOETHYL)THIAZOLE DIHYDROCHLORIDE; 2-(Thiazol-4-yl)ethanamine dihydrochloride; 2-Thiazol-4-yl-ethylamine dihydrochloride; 2-(1,3-thiazol-4-yl)ethanamine; dihydrochloride; 4-Thiazoleethanamine Dihydrochloride

Technical Data

Safety and Hazards

Computed Properties

IUPAC Name:	2-(1,3-thiazol-4-yl)ethanaminedihydrochloride
Molecular Weight:	201.11
Molecular Formula:	C5H8N2S·2HCl
Canonical SMILES:	C1=C(N=CS1)CCN.Cl.Cl
InChI:	InChI=1S/C5H8N2S.2ClH/c6-2-1-5-3-8-4-7-5/h3-4H,1-2,6H22*1H
InChI Key:	WNBVPHXGUOQHFD-UHFFFAOYSA-N

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
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:	67.4
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	3
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	199.9941749
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	199.9941749
Rotatable Bond Count:	2
Topological Polar Surface Area:	67.2Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0