AG01DIKJ

321318-11-0 | 1-(3,5-Difluorophenyl)Ethanamine Hydrochloride

AG01DIKJ

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CAS Number	321318-11-0
Catalog Number	AG01DIKJ(AGN-PC-0R7G75)
Chemical Name	1-(3,5-Difluorophenyl)Ethanamine Hydrochloride
IUPAC Name	1-(3,5-difluorophenyl)ethanamine;hydrochloride
InChI	InChI=1S/C8H9F2N.ClH/c1-5(11)6-2-7(9)4-8(10)3-6;/h2-5H,11H2,1H3;1H
InChI Key	YSKNBJOMVKILCE-UHFFFAOYSA-N
MDL Number	MFCD29049508
Molecular Formula	C8H10ClF2N
Molecular Weight	193.6215
SMILES	NC(C)C1C=C(F)C=C(F)C=1.[H]Cl
Synonyms	1-(3,5-difluorophenyl)ethanamine hydrochloride, 321318-11-0, 1-(3,5-difluorophenyl)ethan-1-amine hydrochloride, AK-42191, AK-42228, SCHEMBL1003419, YSKNBJOMVKILCE-UHFFFAOYSA-N, AKOS032947599, AN-28401, AX8279037, (RS)-1-(3,5-Difluorophenyl)ethylamine HCl, 4CH-018891, CS-0047136, 1-(3,5-difluorophenyl)ethanamine;hydrochloride, 1-(3,5-difluorophenyl)ethylamine hydrochloride, 1-(3,5-DIFLUOROPHENYL)ETHAN-1-AMINE HCL, A826585, (1R)-1-(3,5-difluorophenyl)ethanamine;hydrochloride, (1S)-1-(3,5-difluorophenyl)ethanamine;hydrochloride, 1-[3,5-bis(fluoranyl)phenyl]ethanamine hydrochloride, ACN-054720, (S)-1-(3,5-Difluorophenyl)ethanamine hydrochloride, (R)-1-(3,5-DIFLUOROPHENYL)ETHANAMINE HYDROCHLORIDE, 321318-28-9, 1213128-98-3, (RS)-1-(3,5-DIFLUOROPHENYL)ETHYLAMINE HYDROCHLORIDE, 1-(3,5-Difluorophenyl)ethan-1-amine hydrochloride, 97% - 1G 1g, 321318-29-0, 444643-16-7,

Complexity	119
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	193.047g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	193.622g/mol
Monoisotopic Mass	193.047g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code	\N

Certificate of Analysis

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