AG003KNJ

39143-25-4 | 4-amino-1-benzylpiperidine-4-carboxylic acid

AG003KNJ

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CAS Number	39143-25-4
Catalog Number	AG003KNJ(AGN-PC-0K5TFH)
Chemical Name	4-amino-1-benzylpiperidine-4-carboxylic acid
IUPAC Name	4-amino-1-benzylpiperidine-4-carboxylic acid
InChI	InChI=1S/C13H18N2O2/c14-13(12(16)17)6-8-15(9-7-13)10-11-4-2-1-3-5-11/h1-5H,6-10,14H2,(H,16,17)
InChI Key	UAPJXCZSNCQLMR-UHFFFAOYSA-N
MDL Number	MFCD00794952
Molecular Formula	C13H18N2O2
Molecular Weight	234.2942
SMILES	O=C(C1(N)CCN(CC2=CC=CC=C2)CC1)O
Synonyms	4-Amino-1-benzylpiperidine-4-carboxylic Acid, 39143-25-4, 4-amino-1-benzyl-piperidine-4-carboxylic Acid, 4-AMINO-1-BENZYL-4-PIPERIDINECARBOXYLIC ACID, 4-PIPERIDINECARBOXYLIC ACID, 4-AMINO-1-(PHENYLMETHYL)-, C13H18N2O2, 1-Benzyl-4-amino-4-piperidinecarboxylic acid, AC1LS0D0, SCHEMBL1975609, Jsp006803, AMPD00286, CTK1C1282, KS-00000ADQ, DTXSID60363188, UAPJXCZSNCQLMR-UHFFFAOYSA-N, 4-Amino-1-benzylisonipecotic acid, KS-000023KH, ANW-61323, MFCD00794952, SBB053322, ZINC36023045, 1-benzyl-4-amino-4-carboxypiperidine, AKOS000176781, AB07147, AC-3146, AM86028, BS-9742, CA-1948, CS-W006436, RP28124, TRA0026753, AJ-92336, AK-48216, AN-13248, BR-48216, SC-23216, SY004038, AB0044073, AB1000016, DB-012140, TC-066296, 4-Amino-1-benzylpiperidine-4-carboxylicAcid, FT-0659217, ST24043187, W5954, A23024, S-1203, MFCD00794952 (95+%), 10G-966, 143A254, A1-00527, I14-3850, J-515960, 4-Amino-1-(phenylmethyl)-4-piperidinecarboxylic acid, 4-Piperidinecarboxylicacid, 4-amino-1-(phenylmethyl)-, 4-amino-1-benzyl-piperidine-4-carboxylic acid, AldrichCPR, CID1480362, 4-AMINO-1-BENZYL-PIPERIDINE-4-CARBOXYLICACID, 3,4,5-Trimethoxybenzoic acid 2-(dimethylamino)-2-phenylbutyl ester, 800402-07-7,

Complexity	267
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	234.137g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	234.299g/mol
Monoisotopic Mass	234.137g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	66.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.5

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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