AG004O05

876716-43-7 | 1-Cyclopropyl-5-oxopyrrolidine-3-carboxylic Acid

AG004O05

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CAS Number	876716-43-7
Catalog Number	AG004O05(AGN-PC-0WB3GA)
Chemical Name	1-Cyclopropyl-5-oxopyrrolidine-3-carboxylic Acid
IUPAC Name	1-cyclopropyl-5-oxopyrrolidine-3-carboxylic acid
InChI	InChI=1S/C8H11NO3/c10-7-3-5(8(11)12)4-9(7)6-1-2-6/h5-6H,1-4H2,(H,11,12)
InChI Key	AJVZAQNEJHXULB-UHFFFAOYSA-N
MDL Number	MFCD11040202
Molecular Formula	C8H11NO3
Molecular Weight	169.1778
SMILES	N1(C2CC2)CC(CC1=O)C(O)=O
Synonyms	1-cyclopropyl-5-oxopyrrolidine-3-carboxylic acid, 876716-43-7, 1-Cyclopropyl-5-oxo-pyrrolidine-3-carboxylic acid, 1-Cyclopropyl-5-oxo-3-pyrrolidinecarboxylic acid, BAS 10150050, AC1NFUZ0, AC1Q74P1, SCHEMBL3655855, CTK5F8852, DTXSID40405792, AJVZAQNEJHXULB-UHFFFAOYSA-N, HMS1698A22, ALBB-010702, 1347AF, BBL030594, HTS028437, MFCD06660782, SBB050504, STL299802, AKOS000122798, AKOS016340858, MCULE-6763681237, NCGC00341886-01, DB-013838, BB 0217935, FT-0677718, ST24037969, ST50289517, EN300-12440, Y-2386, AB01137764-03, 3-pyrrolidinecarboxylic acid, 1-cyclopropyl-5-oxo-, I04-1442, F8881-7761, Z235344637, C8H11NO3, ACN-039439, CID4714359, 1-CYCLOPROPYL-5-OXOPYRROLIDINE-3-CARBOXYLICACID,

Complexity	235
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	169.074g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	169.18g/mol
Monoisotopic Mass	169.074g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	57.6A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	-0.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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