AG000VIE

1310923-28-4 | (1S)-1-(2-fluorophenyl)propan-1-amine hydrochloride

AG000VIE

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CAS Number	1310923-28-4
Catalog Number	AG000VIE(AGN-PC-0WAN1N)
Chemical Name	(1S)-1-(2-fluorophenyl)propan-1-amine hydrochloride
IUPAC Name	(1S)-1-(2-fluorophenyl)propan-1-amine;hydrochloride
InChI	InChI=1S/C9H12FN.ClH/c1-2-9(11)7-5-3-4-6-8(7)10;/h3-6,9H,2,11H2,1H3;1H/t9-;/m0./s1
InChI Key	VVIJOOJNOZEOGM-FVGYRXGTSA-N
MDL Number	MFCD12757044
Molecular Formula	C9H13ClFN
Molecular Weight	189.6576
SMILES	CC[C@@H](C1=CC=CC=C1F)N.[H]Cl
Synonyms	(S)-1-(2-Fluorophenyl)propan-1-amine hydrochloride, 1310923-28-4, 1075715-56-8, (S)-1-(2-Fluorophenyl)propan-1-amine HCl, SCHEMBL20238472, KS-00000RJU, DTXSID20704159, MFCD12757044, AKOS015923133, DS-4745, ST2414529, (1S)-1-(2-fluorophenyl)propan-1-amine hydrochloride, (1S)-1-(2-Fluorophenyl)propan-1-amine--hydrogen chloride (1/1), Benzenemethanamine, alpha-ethyl-2-fluoro-, hydrochloride (1:1), (alphaS)-, ACN-030805, (S)-1-(2-FLUOROPHENYL)PROPAN-1-AMINE-HCl, (1S)-1-(2-fluorophenyl)propan-1-amine;hydrochloride, Benzenemethanamine, -ethyl-2-fluoro-, hydrochloride (1:1), (S),

Complexity	116
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	189.072g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	189.658g/mol
Monoisotopic Mass	189.072g/mol
Rotatable Bond Count	2
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	P261-P305+P351+P338
UN Code

Certificate of Analysis

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