AG000MKQ

1246649-06-8 | Benzenemethanamine, 4-iodo-α-methyl-, hydrochloride (1:1), (αR)-

AG000MKQ

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CAS Number	1246649-06-8
Catalog Number	AG000MKQ(AGN-PC-0WA2HA)
Chemical Name	Benzenemethanamine, 4-iodo-α-methyl-, hydrochloride (1:1), (αR)-
IUPAC Name	(1R)-1-(4-iodophenyl)ethanamine;hydrochloride
InChI	InChI=1S/C8H10IN.ClH/c1-6(10)7-2-4-8(9)5-3-7;/h2-6H,10H2,1H3;1H/t6-;/m1./s1
InChI Key	PZYFIOFVFANOJA-FYZOBXCZSA-N
MDL Number	MFCD12756020
Molecular Formula	C8H11ClIN
Molecular Weight	283.5371
SMILES	C[C@@H](N)C1=CC=C(I)C=C1.[H]Cl
Synonyms	(R)-1-(4-Iodophenyl)ethanamine hydrochloride, 1246649-06-8, (R)-1-(4-iodophenyl)ethanamine-HCl, (R)-1-(4-Iodophenyl)ethanamine HCl, (1S)-1-(4-iodophenyl)ethylamine, AK-43006, CTK8B4762, KS-00000Q3J, ANW-46092, MFCD12756020, AKOS015890325, DS-14108, AB0000267, AX8232014, ST2402571, TC-134837, FT-0084311, W7028, Benzenemethanamine, 4-iodo-a-methyl-, (S)-, B-2071, (r)-4-iodo-a-methylbenzenemethanamine hydrochloride, I01-6079, C8H11ClIN, ACN-030731, (R)-1-(4-Iodophenyl)ethanaminehydrochloride, 56639-48-6,

Complexity	97.4
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	282.962g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	283.537g/mol
Monoisotopic Mass	282.962g/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	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number