AG01DU7U

2089389-09-1 | (1S)-1-(4-Fluoro-3-methoxyphenyl)ethylamine-hcl

AG01DU7U

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CAS Number	2089389-09-1
Catalog Number	AG01DU7U
Chemical Name	(1S)-1-(4-Fluoro-3-methoxyphenyl)ethylamine-hcl
IUPAC Name	1-(4-fluoro-3-methoxyphenyl)ethanamine;hydrochloride
InChI	InChI=1S/C9H12FNO.ClH/c1-6(11)7-3-4-8(10)9(5-7)12-2;/h3-6H,11H2,1-2H3;1H
InChI Key	HBJULLIYARHDSU-UHFFFAOYSA-N
MDL Number	MFCD16294098
Molecular Formula	C9H13ClFNO
Molecular Weight	205.6570
SMILES	C[C@H](N)C1=CC=C(F)C(OC)=C1.[H]Cl
Synonyms	(S)-1-(4-Fluoro-3-methoxyphenyl)ethanamine hydrochloride, 2089389-09-1, AK-42093, SCHEMBL15210760, AKOS032947606, AK684510, 4CH-018984, (1R)-1-(4-fluoro-3-methoxyphenyl)ethanamine;hydrochloride, (R)-1-(4-Fluoro-3-methoxyphenyl)ethanamine hydrochloride, 1256944-96-3,

Complexity	143
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	205.067g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	205.657g/mol
Monoisotopic Mass	205.067g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	35.2A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0

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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