AG00AP54

185692-51-7 | 2-Benzyl-hexahydro-cyclopenta[c]pyrrol-4-one

AG00AP54

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CAS Number	185692-51-7
Catalog Number	AG00AP54(AGN-PC-00MO08)
Chemical Name	2-Benzyl-hexahydro-cyclopenta[c]pyrrol-4-one
IUPAC Name	2-benzyl-1,3,3a,5,6,6a-hexahydrocyclopenta[c]pyrrol-4-one
InChI	InChI=1S/C14H17NO/c16-14-7-6-12-9-15(10-13(12)14)8-11-4-2-1-3-5-11/h1-5,12-13H,6-10H2
InChI Key	DLTLETIGPVMJIX-UHFFFAOYSA-N
MDL Number	MFCD06658339
Molecular Formula	C14H17NO
Molecular Weight	215.2909
SMILES	O=C1CCC2CN(CC3=CC=CC=C3)CC21
Synonyms	185692-51-7, 2-Benzylhexahydrocyclopenta[c]pyrrol-4(2H)-one, 2-Benzyl-hexahydro-cyclopenta[c]pyrrol-4-one, 2-Benzylhexahydrocyclopenta[c]pyrrol-4(1H)-one, 2-benzylhexahydrocyclopenta[c]pyrrol-4(5H)-one, 2-benzyl-octahydrocyclopenta[c]pyrrol-4-one, 7-BENZYL-2-OXO-7-AZABICYCLO[3.3.0]OCTANE, HEXAHYDRO-2-(PHENYLMETHYL)-CYCLOPENTA[C]PYRROL-4(1H)-ONE, 2-Benzylhexahydrocyclopenta[c]pyrrol-4-one, 101046-32-6, 2-benzyl-hexahydrocyclopenta[c]pyrrol-4(5H)-one, SCHEMBL46233, CTK0H1303, DTXSID90541472, DLTLETIGPVMJIX-UHFFFAOYSA-N, AB1154, MFCD06658339, SBB095135, AKOS005073274, AS06322, CM10254, PB18732, RP07756, RTR-008571, AN-30341, SC-45672, 2-benzyl-hexahydrocyclopenta[c]pyrrol-4-one, AB0038715, DB-065540, TR-008571, 7-benzyl-7-azabicyclo[3.3.0]octan-2-one, AM20030220, FT-0681179, Y6101, 7-benzyl-2-oxo-7-azabicyclo [3.3.0]octane, B65642, Q-2361, 692B517, I11-768, W-206336, 2-(phenylmethyl)hexahydrocyclopenta[c]pyrrol-4(1H)-one, racemic-2-benzylhexahydrocyclopenta[c]pyrrol-4(1h)-one, 2-Benzylhexahydrocyclopenta[c]pyrrol-4(1H)-one, AldrichCPR, 2-N-BENZYL-HEXAHYDROCYCLOPENTA[C] PYRROL-4(1H)-ONE, 2-benzyl-1,3,3a,5,6,6a-hexahydrocyclopenta[c]pyrrol-4-one, Cyclopenta[c]pyrrol-4(1H)-one, hexahydro-2-(phenylmethyl)-, Cyclopenta[c]pyrrol-4(1H)-one, hexahydro-2-(phenylmethyl)-, cis-, C14H17NO, ACN-044574, A4108, cis-2-Benzylhexahydrocyclopenta[c]pyrrol-4(1H)-one,

Complexity	270
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	215.131g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	215.296g/mol
Monoisotopic Mass	215.131g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	20.3A^2
Undefined Atom Stereocenter Count	2
Undefined Bond Stereocenter Count	0
XLogP3	1.6

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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