AG00355D

3939-01-3 | Methyl 1-benzyl-4-oxo-3-piperidinecarboxylate, HCl

AG00355D

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CAS Number	3939-01-3
Catalog Number	AG00355D(AGN-PC-0JLFX6)
Chemical Name	Methyl 1-benzyl-4-oxo-3-piperidinecarboxylate, HCl
EC Number	223-522-2
IUPAC Name	methyl 1-benzyl-4-oxopiperidine-3-carboxylate;hydrochloride
InChI	InChI=1S/C14H17NO3.ClH/c1-18-14(17)12-10-15(8-7-13(12)16)9-11-5-3-2-4-6-11;/h2-6,12H,7-10H2,1H3;1H
InChI Key	BRADBAOVPACOQQ-UHFFFAOYSA-N
MDL Number	MFCD00012799
Molecular Formula	C14H18ClNO3
Molecular Weight	283.7506
SMILES	Cl.C(C1=CC=CC=C1)N1CC(C(CC1)=O)C(=O)OC
Synonyms	3939-01-3, Methyl 1-benzyl-4-oxopiperidine-3-carboxylate hydrochloride, Methyl 1-benzyl-4-oxo-3-piperidinecarboxylate hydrochloride, Methyl 1-benzyl-4-oxo-3-piperidine-carboxylate hydrochloride, 1-Benzyl-3-carbomethoxy-4-piperidone hydrochloride, 1-Benzyl-3-methoxycarbonyl-4-piperidone Hydrochloride, MFCD00012799, AK-47640, C14H18ClNO3, Methyl 1-benzyl-4-oxo-3-piperidinecarboxylate, HCl, W-106445, METHYL 1-BENZYL-4-OXOPIPERIDINE-3-CARBOXYLATE HCL, 1-Benzyl-3-methoxycarbonyl-4-piperidone HCl, Methyl 1-benzyl-4-oxo-3-piperidine-carboxylate hydrochloride, 97%, PubChem12956, AC1Q3EPB, ACMC-1CLL5, KSC790S5L, SCHEMBL719130, AC1L327Y, Jsp000017, methyl-1-benzyl-4-oxopiperidin-3-carboxylathydrochlorid, CTK6J0955, BRADBAOVPACOQQ-UHFFFAOYSA-N, KS-000001YS, EINECS 223-522-2, ANW-50439, AKOS015847159, AC-1762, CB-1509, CS-W002080, TRA-0184295, AN-14625, BC681877, BR-47640, SC-53662, SY020177, TS-01013, AX8105775, DB-049409, ST2413214, TL8001005, TR-015765, FT-0635068, M2531, W5977, M-7514, MFCD00012799 (95+%), 1-benzyl-3-carbomethoxy-4-piperidone-hydrochloride, C-49648, Methyl 1-benzyl-4-oxo-3-piperidine-carboxylate hyd, 1-benzyl-3-methoxycarbonyl-4-oxopiperidine hydrochloride, methyl 1-benzyl-4-oxo-piperidine-3-carboxylate hydrochloride, Methyl 1-benzyl-4-oxo-3-piperidinecarboxylate hydrochloride (1:1), Methyl 1-benzyl-4-oxo-3-piperidinecarboxylate hydrochloride, 95%, METHYL-1-BENZYL-4-OXO-3-PIPERIDINECARBOXYLATE HYDROCHLORIDE, 1-Benzyl-4-oxo-3-piperidinecarboxylic Acid Methyl Ester Hydrochloride, 1-benzyl-4-oxo-piperidine-3-carboxylic acid methyl ester hydrochloride, 1-benzyl-4-oxo-piperidine-3-carboxylic acid methyl ester hydrochloride salt, 1-benzyl-4-oxopiperidine-3-carboxylic acid methyl ester hydrochloride, 4-oxo-1-(phenylmethyl)-3-piperidinecarboxylic acid methyl ester, hydrochloride, 3-BROMOBIPHENYL, AR-1J6613, CID107479, Ethyl 1-benzyl-4-oxopiperidine-3-carboxylate hydrochloride, 1454-53-1, 57611-47-9, Methyl 1-benzyl-4-oxo-3-piperidinecarboxylate hydrochloride, 95% - 25G 25g, 4113-04-6,

Complexity	310
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	283.098g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	283.752g/mol
Monoisotopic Mass	283.098g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	46.6A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number