AG008XMU

1185121-45-2 | 2-(4-TRIFLUOROMETHOXY-PHENYL)-PYRROLIDINE, HYDROCHLORIDE

AG008XMU

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CAS Number	1185121-45-2
Catalog Number	AG008XMU(AGN-PC-0WAM9E)
Chemical Name	2-(4-TRIFLUOROMETHOXY-PHENYL)-PYRROLIDINE, HYDROCHLORIDE
IUPAC Name	2-[4-(trifluoromethoxy)phenyl]pyrrolidine;hydrochloride
InChI	InChI=1S/C11H12F3NO.ClH/c12-11(13,14)16-9-5-3-8(4-6-9)10-2-1-7-15-10;/h3-6,10,15H,1-2,7H2;1H
InChI Key	CQVGKBSZXQYCTD-UHFFFAOYSA-N
MDL Number	MFCD08456904
Molecular Formula	C11H13ClF3NO
Molecular Weight	267.6752
SMILES	FC(F)(F)OC1=CC=C(C2NCCC2)C=C1.[H]Cl
Synonyms	1185121-45-2, 2-(4-(Trifluoromethoxy)phenyl)pyrrolidine hydrochloride, 2-(4-(TRIFLUOROMETHOXY)PHENYL)PYRROLIDINE HCL, 2-(4-trifluoromethoxy-phenyl)-pyrrolidine, 1391490-20-2, 2-(4-TRIFLUOROMETHOXY-PHENYL)-PYRROLIDINE, HYDROCHLORIDE, MFCD08456904, AKOS025395734, DS-8128, KS-00000T08, AK172676, AX8297637, 2-(4-trifluoromethoxyphenyl)pyrrolidine hydrochloride, 2-(4-Trifluoromethoxy-phenyl)-pyrrolidine hydrochloride, (R)-2-(4-(TRIFLUOROMETHOXY)PHENYL)PYRROLIDINE HCL,

Complexity	224
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	267.064g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	267.676g/mol
Monoisotopic Mass	267.064g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	21.3A^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

Lot Number