AG001AEF

1391455-00-7 | Benzenemethanamine, α-cyclopropyl-3-methoxy-, hydrochloride (1:1), (αR)-

AG001AEF

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CAS Number	1391455-00-7
Catalog Number	AG001AEF(AGN-PC-0WAMQK)
Chemical Name	Benzenemethanamine, α-cyclopropyl-3-methoxy-, hydrochloride (1:1), (αR)-
IUPAC Name	(R)-cyclopropyl-(3-methoxyphenyl)methanamine;hydrochloride
InChI	InChI=1S/C11H15NO.ClH/c1-13-10-4-2-3-9(7-10)11(12)8-5-6-8;/h2-4,7-8,11H,5-6,12H2,1H3;1H/t11-;/m1./s1
InChI Key	YZEPXOHQBWEEEY-RFVHGSKJSA-N
MDL Number	MFCD19705372
Molecular Formula	C11H16ClNO
Molecular Weight	213.7038
SMILES	N[C@H](C1CC1)C2=CC=CC(OC)=C2.[H]Cl
Synonyms	1391455-00-7, (R)-Cyclopropyl(3-methoxyphenyl)methanamine hydrochloride, (1R)Cyclopropyl(3-methoxyphenyl)methylamine HCl, (1R)CYCLOPROPYL(3-METHOXYPHENYL)METHYLAMINE-HCl, KS-00000OHQ, DTXSID30704261, KS-000026EJ, MFCD19705372, AKOS015923295, GS-7229, AB0000043, AX8209836, (R)-1-Cyclopropyl-1-(3-methoxyphenyl)methanamine hydrochloride, (R)-1-Cyclopropyl-1-(3-methoxyphenyl)methanamine--hydrogen chloride (1/1), Benzenemethanamine, alpha-cyclopropyl-3-methoxy-, hydrochloride (1:1), (alphaR)-, ACN-055263, (R)-Cyclopropyl(3-methoxyphenyl)methanaminehydrochloride, 1212958-89-8,

Complexity	168
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	213.092g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	213.705g/mol
Monoisotopic Mass	213.092g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	35.2A^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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