AG003D1I

214759-44-1 | 1-(5-CHLOROTHIEN-2-YL)ETHANAMINE

AG003D1I

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CAS Number	214759-44-1
Catalog Number	AG003D1I(AGN-PC-05WH6I)
Chemical Name	1-(5-CHLOROTHIEN-2-YL)ETHANAMINE
IUPAC Name	1-(5-chlorothiophen-2-yl)ethanamine
InChI	InChI=1S/C6H8ClNS/c1-4(8)5-2-3-6(7)9-5/h2-4H,8H2,1H3
InChI Key	POVBCAPIAGIBEW-UHFFFAOYSA-N
MDL Number	MFCD05215241
Molecular Formula	C6H8ClNS
Molecular Weight	161.6524
SMILES	CC(C1SC(Cl)=CC=1)N
Synonyms	214759-44-1, 1-(5-chlorothiophen-2-yl)ethanamine, 1-(5-chlorothien-2-yl)ethanamine, 1-(5-Chloro-2-thienyl)ethylamine, 1-(5-chlorothiophen-2-yl)ethan-1-amine, 303070-27-1, 1-(5-Chlorothiophen-2-yl)ethylamine, AC1N8YCH, AC1Q2B8C, SCHEMBL1239420, CTK4E6878, DTXSID60402586, POVBCAPIAGIBEW-UHFFFAOYSA-N, 1-(5-chloro-2-thienyl)ethanamine, 303070-26-0, ALBB-000032, 7287AD, BBL017882, MFCD05215241, STK488081, AKOS000123215, AKOS016344049, MCULE-8664329980, RTR-036148, 1-(5-chloro-thiophen-2-yl)-ethylamine, TRA-0204898, AS-31594, SY011757, DB-066529, BB 0254283, FT-0678398, EN300-36076, MFCD05215241 (95%), K-6143, I05-1840, I14-17736, C6H8ClNS, CID4376996, (1R)-1-(5-chlorothiophen-2-yl)ethan-1-amine, (1S)-1-(5-chlorothiophen-2-yl)ethan-1-amine, 164161-49-3,

Complexity	99.1
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	161.007g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	161.647g/mol
Monoisotopic Mass	161.007g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	54.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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