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CAS No.: | 183483-09-2 |
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Name: | N-Boc-3-piperidineacetic acid |
Molecular Structure: | |
Formula: | C12H21NO4 |
Molecular Weight: | 243.303 |
Synonyms: | 1-tert-Butoxycarbonyl-3-piperidineaceticacid;3-Carboxymethylpiperidine-1-carboxylic acid tert-butyl ester; |
Density: | 1.121 g/cm3 |
Melting Point: | 76-79 °C |
Boiling Point: | 373 °C at 760 mmHg |
Flash Point: | 179.4 °C |
Hazard Symbols: | T,N |
Risk Codes: | 25-50 |
Safety: | 45-61 |
PSA: | 66.84000 |
LogP: | 2.04610 |
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Molecular Structure of 3-Piperidineaceticacid, 1-[(1,1-dimethylethoxy)carbonyl]- (CAS NO.183483-09-2):
IUPAC Name: 2-[1-[(2-Methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]acetic acid
Canonical SMILES: CC(C)(C)OC(=O)N1CCCC(C1)CC(=O)O
InChI: InChI=1S/C12H21NO4/c1-12(2,3)17-11(16)13-6-4-5-9(8-13)7-10(14)15/h9H,4-8H2,1-3H3,(H,14,15)
InChIKey: QZYGREZDLJVVSV-UHFFFAOYSA-N
Molecular Weight: 243.29944 [g/mol]
Molecular Formula: C12H21NO4
XLogP3-AA: 1.4
H-Bond Donor: 1
H-Bond Acceptor: 4
Index of Refraction: 1.486
Molar Refractivity: 62.33 cm3
Molar Volume: 216.8 cm3
Surface Tension: 41.1 dyne/cm
Density: 1.121 g/cm3
Flash Point: 179.4 °C
Enthalpy of Vaporization: 68.1 kJ/mol
Boiling Point: 373 °C at 760 mmHg
Vapour Pressure: 1.37E-06 mmHg at 25 °C
Melting Point: 76-79 °C
Product Categories: pharmacetical
Safety Information of 3-Piperidineaceticacid, 1-[(1,1-dimethylethoxy)carbonyl]- (CAS NO.183483-09-2):
HazardClass: IRRITANT
3-Piperidineaceticacid, 1-[(1,1-dimethylethoxy)carbonyl]- (CAS NO.183483-09-2), its Synonyms are (1-tert-Butoxycarbonylpiperidin-3-yl)acetic acid ; 3-Carboxymethyl-piperidine-1-carboxylic acid tert-butyl ester ; N-Boc-3-piperidineacetic acid .