AG00376A

59045-82-8 | (S)-(+)-Nipecotic Acid

AG00376A

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CAS Number	59045-82-8
Catalog Number	AG00376A(AGN-PC-0OCU0L)
Chemical Name	(S)-(+)-Nipecotic Acid
IUPAC Name	(3S)-piperidine-3-carboxylic acid
InChI	InChI=1S/C6H11NO2/c8-6(9)5-2-1-3-7-4-5/h5,7H,1-4H2,(H,8,9)/t5-/m0/s1
InChI Key	XJLSEXAGTJCILF-YFKPBYRVSA-N
MDL Number	MFCD01630807
Molecular Formula	C6H11NO2
Molecular Weight	129.1570
SMILES	O=C(O)[C@H]1CCCNC1
UNII	2635N2PS4Q
Synonyms	59045-82-8, (S)-Piperidine-3-carboxylic acid, (S)-(+)-Nipecotic acid, (3S)-piperidine-3-carboxylic acid, (S)-nipecotic acid, (+)-nipecotic acid, (3S)-nipecotic acid, (S)-(+)-3-Piperidinecarboxylic acid, (S)-hexahydronicotinic acid, (+)-hexahydronicotinic acid, (3S)-hexahydronicotinic acid, L(+)-NIPECOTIC ACID, CHEBI:222169, (3S)-3-piperidinecarboxylic acid, 3-Piperidinecarboxylic acid, (3S)-, (S)-(+)-PIPERIDINE-3-CARBOXYLIC ACID, UNII-2635N2PS4Q, (3S)-(+)-piperidine-3-carboxylic acid, MFCD01630807, L-PIPERIDINE-3-CARBOXYLIC ACID, (S)-3-PIPERIDINECARBOXYLIC ACID, CHEMBL77484, (+)-piperidine-3-carboxylic acid, 2635N2PS4Q, (S)-(+)-Nipecotic acid, 96%, S(+)-nipecotic acid, H-BETA-HOPRO-OH, (S)-(+)-Nipecoticacid, Nipecotic acid, S(+)-, D-piperidine-3-carboxylic acid, 3-Piperidinecarboxylic acid, (S)-, PubChem5657, Tocris-0236, L-NIPECOTIC ACID, J423.228C, Lopac-211672, KSC269G1T, SCHEMBL254683, AC1O78L7, CTK1G9319, piperidine-3-(S)-carboxylic acid, XJLSEXAGTJCILF-YFKPBYRVSA-N, 3-Piperidinecarboxylicacid, (3S)-, ACT05132, ZINC3861497, ANW-33138, BDBM50020888, CN0014, AKOS006238145, AKOS015854507, AC-6184, AN-9895, DS-1478, PB29158, RL04227, RTR-020494, SB10229, KS-0000033P, NCGC00014992-01, NCGC00014992-02, NCGC00024510-01, AJ-46198, BC213392, BC667219, BR-30334, SC-05572, AB0010693, AB1004210, ST2402885, TR-020494, FT-0630059, N0678, (S)-(+)-3-Piperidinecarboxylic acid, 97%, S-1737, 045N828, Q-103036, F0001-2356, UNII-1U1QTN40SY component XJLSEXAGTJCILF-YFKPBYRVSA-N, nipecotic acid, (R)-nipecotic acid, L-BETA-HOMOPROLINE, Piperidine-3-carboxylic acid, D03IWW, D0D2EF, (R)-(-)-Nipecotic acid, C6H11NO2, ACN-047911, CB11619, CID6575389, A8322, (S)-( )-3-Piperidinecarboxylic acid, 98% - 1G 1g, 25137-00-2, (2R,4R)-3-BENZYLOXYCARBONYL-4-METHYL-2-PHENYL-1,3-OXAZOLIDIN-5-ONE, 143564-89-0, 498-95-3, 851956-01-9,

Complexity	114
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	129.079g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	129.159g/mol
Monoisotopic Mass	129.079g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	49.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-2.9

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

Lot Number