AG007D51

172349-10-9 | 5-(Aminomethyl)thiophene-2-carbonitrile hydrochloride

AG007D51

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CAS Number	172349-10-9
Catalog Number	AG007D51(AGN-PC-0QA2CG)
Chemical Name	5-(Aminomethyl)thiophene-2-carbonitrile hydrochloride
IUPAC Name	5-(aminomethyl)thiophene-2-carbonitrile;hydrochloride
InChI	InChI=1S/C6H6N2S.ClH/c7-3-5-1-2-6(4-8)9-5;/h1-2H,3,7H2;1H
InChI Key	ORXSASOZUVSWPV-UHFFFAOYSA-N
MDL Number	MFCD06658320
Molecular Formula	C6H7ClN2S
Molecular Weight	174.6512
SMILES	Cl.NCC1SC(C#N)=CC=1
Synonyms	172349-10-9, 5-(aminomethyl)thiophene-2-carbonitrile hydrochloride, 5-(AMINOMETHYL)-2-THIOPHENECARBONITRILE HYDROCHLORIDE, 5-Aminomethyl-thiophene-2-carbonitrile hydrochloride, 5-(AMINOMETHYL)THIOPHENE-2-CARBONITRILE HCL, SCHEMBL589082, DTXSID30619088, AB1094, MFCD06658320, AKOS016000931, MCULE-9144834090, QC-6114, AS-44511, SC-59838, AB0085557, DB-064848, RT-010173, ST2418569, 4CH-012826, FT-0714530, L-4568, 349A109, A811407, F2147-0916, Z1198169449, 2-Thiophenecarbonitrile, 5-(aminomethyl)-, monohydrochloride, 5-(aminomethyl)-2-thiophenecarbonitrile hydrochloride, AldrichCPR, 5-(Aminomethyl)thiophene-2-carbonitrile--hydrogen chloride (1/1), ORXSASOZUVSWPV-UHFFFAOYSA-N, 5-AMINOMETHYL-THIOPHENE-2-CARBONITRILE,

Complexity	137
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	174.002g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	174.646g/mol
Monoisotopic Mass	174.002g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	78A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301
Packing Group	Ⅲ
Precautionary statements	P301+P310
UN Code	UN 2811

Certificate of Analysis

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