AG01DU7T

1998215-83-0 | 2-(2-(Methylthio)phenyl)pyrrolidine hydrochloride

AG01DU7T

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CAS Number	1998215-83-0
Catalog Number	AG01DU7T(AGN-PC-0WNGEN)
Chemical Name	2-(2-(Methylthio)phenyl)pyrrolidine hydrochloride
IUPAC Name	2-(2-methylsulfanylphenyl)pyrrolidine;hydrochloride
InChI	InChI=1S/C11H15NS.ClH/c1-13-11-7-3-2-5-9(11)10-6-4-8-12-10;/h2-3,5,7,10,12H,4,6,8H2,1H3;1H
InChI Key	ZADRPOCZVUWDGS-UHFFFAOYSA-N
MDL Number	MFCD29049516
Molecular Formula	C11H16ClNS
Molecular Weight	229.7694
SMILES	CSC1=CC=CC=C1C2NCCC2.[H]Cl
Synonyms	2-(2-(Methylthio)phenyl)pyrrolidine hydrochloride, 1998215-83-0, KS-00000TM4, MFCD29049516, 2-(2-(Methylthio)phenyl)pyrrolidine HCl, AK542981, DS-19181,

Complexity	160
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	229.069g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	229.766g/mol
Monoisotopic Mass	229.069g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	37.3A^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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