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1-Boc-3-piperidinecarboxylic acid

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Name

1-Boc-3-piperidinecarboxylic acid

EINECS N/A
CAS No. 84358-12-3 Density 1.164 g/cm3
PSA 66.84000 LogP 1.65600
Solubility N/A Melting Point 159-162 °C(lit.)
Formula C11H19NO4 Boiling Point 353.2 °C at 760 mmHg
Molecular Weight 229.276 Flash Point 167.4 °C
Transport Information N/A Appearance white crystalline powder
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 84358-12-3 (1-Boc-3-piperidinecarboxylic acid) Hazard Symbols IrritantXi
Synonyms

1,3-Piperidinedicarboxylicacid, 1-(1,1-dimethylethyl) ester;1,3-Piperidinedicarboxylicacid 1-tert-butyl ester;1-(tert-Butoxycarbonyl)-3-piperidinecarboxylic acid;1-Boc-piperidine-3-carboxylic acid;1-tert-Butoxycarbonylnipecotic acid;1-tert-Butyl1,3-piperidinedicarboxylate;N-(tert-Butoxycarbonyl)nipecotic acid;N-(tert-Butoxycarbonyl)piperidine-3-carboxylic acid;N-BOC-nipecotic acid;

Article Data 42

1-Boc-3-piperidinecarboxylic acid Chemical Properties

Molecular Structure of 1-Boc-3-piperidinecarboxylic acid (CAS NO.84358-12-3):

IUPAC Name: 1-[(2-Methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid
Canonical SMILES: CC(C)(C)OC(=O)N1CCCC(C1)C(=O)O
InChI: InChI=1S/C11H19NO4/c1-11(2,3)16-10(15)12-6-4-5-8(7-12)9(13)14/h8H,4-7H2,1-3H3,(H,13,14)
InChIKey: NXILIHONWRXHFA-UHFFFAOYSA-N
Molecular Weight: 229.27286 [g/mol]
Molecular Formula: C11H19NO4
XLogP3-AA: 1.1
H-Bond Donor: 1
H-Bond Acceptor: 4 
Index of Refraction: 1.496
Molar Refractivity: 57.54 cm3
Molar Volume: 196.9 cm3
Surface Tension: 44.7 dyne/cm
Density: 1.164 g/cm3
Flash Point: 167.4 °C
Enthalpy of Vaporization: 65.71 kJ/mol
Boiling Point: 353.2 °C at 760 mmHg
Vapour Pressure: 6.15E-06 mmHg at 25 °C
Appearance: White crystalline powder
Melting Point: 159-162 °C(lit.)
storage temp.: Store at 0-5 °C
Product Categories: Carboxylic Acids; Pyrans, Piperidines & Piperazines; Piperidine; API intermediates; Piperidines; Carboxylic Acids; Pyrans, Piperidines & Piperazines; Others; Peptide Synthesis; Unnatural Amino Acid Derivatives

1-Boc-3-piperidinecarboxylic acid Safety Profile

Safety Information of 1-Boc-3-piperidinecarboxylic acid (CAS NO.84358-12-3):
Hazard Codes: IrritantXi
Risk Statements: 36/37/38 
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36:Wear suitable protective clothing.
WGK Germany: 3
Hazard Note: Irritant

1-Boc-3-piperidinecarboxylic acid Specification

 1-Boc-3-piperidinecarboxylic acid (CAS NO.84358-12-3), its Synonyms are 1,3-Piperidinedicarboxylicacid, 1-(1,1-dimethylethyl) ester ; 1,3-Piperidinedicarboxylicacid 1-tert-butyl ester ; 1-(tert-Butoxycarbonyl)-3-piperidinecarboxylic acid ;1-Boc-piperidine-3-carboxylic acid ; 1-t-Butoxycarbonyl-3-piperidinecarboxylicacid ; 1-tert-Butoxycarbonylnipecotic acid ; 1-tert-Butyl1,3-piperidinedicarboxylate ; N-(tert-Butoxycarbonyl)nipecotic acid ; N-(tert-Butoxycarbonyl)piperidine-3-carboxylic acid ; N-(tert-Butyloxycarbonyl)piperidine-3-carboxylic acid ; N-BOC-nipecotic acid .

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