AG00E9T2

6304-56-9 | 1-Cyclohexyl-5-oxopyrrolidine-3-carboxylic acid

AG00E9T2

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CAS Number	6304-56-9
Catalog Number	AG00E9T2(AGN-PC-0JOE75)
Chemical Name	1-Cyclohexyl-5-oxopyrrolidine-3-carboxylic acid
IUPAC Name	1-cyclohexyl-5-oxopyrrolidine-3-carboxylic acid
InChI	InChI=1S/C11H17NO3/c13-10-6-8(11(14)15)7-12(10)9-4-2-1-3-5-9/h8-9H,1-7H2,(H,14,15)
InChI Key	JXNDLFWQCQNSRP-UHFFFAOYSA-N
MDL Number	MFCD00661183
Molecular Formula	C11H17NO3
Molecular Weight	211.2576
NSC Number	42973
SMILES	N1(C2CCCCC2)CC(CC1=O)C(O)=O
Synonyms	1-cyclohexyl-5-oxopyrrolidine-3-carboxylic acid, 6304-56-9, 1-Cyclohexyl-5-oxo-pyrrolidine-3-carboxylic acid, 1-cyclohexyl-5-oxo-3-pyrrolidinecarboxylic acid, 3-Pyrrolidinecarboxylicacid, 1-cyclohexyl-5-oxo-, NSC42973, AC1Q6L5K, Oprea1_868729, SCHEMBL891915, AC1L618H, AC1Q74P3, CTK2F8562, DTXSID60285836, JXNDLFWQCQNSRP-UHFFFAOYSA-N, ALBB-005879, BBL008657, HTS004382, KM0691, MFCD00661183, NSC-42973, SBB011264, STK003999, AKOS000143138, AKOS016040995, BS-4200, CCG-202951, MCULE-3681789025, KS-00001M27, BAS 04202613, ST061320, 1-cyclohexyl-5-oxopyrrolidine-3-carboxylic, AB0167702, TR-040563, BB 0217905, EN300-33685, 3-Pyrrolidinecarboxylic acid, 1-cyclohexyl-5-oxo-, AN-056/25005945, Z57467251, 1-CYCLOHEXYL-5-OXO-PYRROLIDINE-3-CARBOXYLICACID, F1799-0580, A3076/0130088, 1-cyclohexyl-5-oxo-pyrrolidine-3-carboxylic acid, AldrichCPR, C11H17NO3, AR-1C2606, CID238546, 6966-95-6,

Complexity	271
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	211.121g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	211.261g/mol
Monoisotopic Mass	211.121g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	57.6A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P301+P312
UN Code

Certificate of Analysis

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