AG01DU64

1227798-73-3 | 1-((2S)PYRROLIDIN-2-YL)-4-METHOXYBENZENE hydrochloride

AG01DU64

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CAS Number	1227798-73-3
Catalog Number	AG01DU64
Chemical Name	1-((2S)PYRROLIDIN-2-YL)-4-METHOXYBENZENE hydrochloride
IUPAC Name	(2S)-2-(4-methoxyphenyl)pyrrolidine;hydrochloride
InChI	InChI=1S/C11H15NO.ClH/c1-13-10-6-4-9(5-7-10)11-3-2-8-12-11;/h4-7,11-12H,2-3,8H2,1H3;1H/t11-;/m0./s1
InChI Key	SEBSLTSQSAXLOG-MERQFXBCSA-N
MDL Number	MFCD08751472
Molecular Formula	C11H16ClNO
Molecular Weight	213.7038
SMILES	COC1=CC=C([C@H]2NCCC2)C=C1.[H]Cl
Synonyms	(s)-2-(4-methoxyphenyl)pyrrolidine hydrochloride, 1227798-73-3, MFCD08751472, AKOS015933883, (S)-2-(4-Methoxyphenyl)pyrrolidine HCl, 1-((2S)PYRROLIDIN-2-YL)-4-METHOXYBENZENE hydrochloride, (r)-2-(4-methoxyphenyl)pyrrolidine hydrochloride, 1227798-75-5,

Complexity	152
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	2
Topological Polar Surface Area	21.3A^2
Undefined Atom Stereocenter Count	0
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-P305+P351+P338
UN Code	\N

Certificate of Analysis

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