AG000TFA

1268810-17-8 | Cyclopropanamine, 1-ethynyl-, hydrochloride (1:1)

AG000TFA

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CAS Number	1268810-17-8
Catalog Number	AG000TFA(AGN-PC-0WAKYJ)
Chemical Name	Cyclopropanamine, 1-ethynyl-, hydrochloride (1:1)
IUPAC Name	1-ethynylcyclopropan-1-amine;hydrochloride
InChI	InChI=1S/C5H7N.ClH/c1-2-5(6)3-4-5;/h1H,3-4,6H2;1H
InChI Key	XBHDGYBZTODLSE-UHFFFAOYSA-N
MDL Number	MFCD28404680
Molecular Formula	C5H8ClN
Molecular Weight	117.5767
SMILES	Cl.C(#C)C1(CC1)N
Synonyms	1268810-17-8, 1-Ethynylcyclopropanamine hydrochloride, 1-ethynylcyclopropan-1-amine hydrochloride, 1-ETHYNYLCYCLOPROPANAMINE HCL, SCHEMBL17824823, CS-B0936, MFCD28404680, AKOS027254494, LS41861, 1-Ethynyl-cyclopropylamine hydrochloride, KS-000005A1, AK204929, AS-39381, 1-ethynylcyclopropan-1-amine;hydrochloride, 1-Amino-1-ethynylcyclopropane hydrochloride, AX8303071, FT-0745247, Cyclopropanamine, 1-ethynyl-, hydrochloride (1:1), Z2787259184, 1-ethynylcyclopropylamine hydrochloride,

Complexity	102
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	117.035g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	117.576g/mol
Monoisotopic Mass	117.035g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P233-P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P330-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
UN Code

Certificate of Analysis

Lot Number