- 1-Piperazinecarboxylicacid, 2-(hydroxymethyl)-, 1,1-dimethylethyl ester,(2S)-
- 1-Piperazinecarboxylicacid, 2,5-dimethyl-, 1,1-dimethylethyl ester, (2R,5S)-rel-
- 1-Piperazinecarboxylicacid, 2-[(phenylmethoxy)methyl]-, 1,1-dimethylethyl ester, (2R)-
- 1-Piperazinecarboxylicacid, 2-formyl-4-(phenylmethyl)-, 1,1-dimethylethyl ester, (2S)-
- 1-Piperazinecarboxylicacid, 3-(hydroxymethyl)-, phenylmethyl ester
- 1-Piperazinecarboxylicacid, 3,5-dimethyl-, 1,1-dimethylethyl ester, (3R,5S)-rel-
- 1-Piperazinecarboxylicacid, 3-cyano-, 1,1-dimethylethyl ester
- 1-Piperazinecarboxylicacid, 4-(1H-indol-4-yl)-, 1,1-dimethylethyl ester
- 1-Piperazinecarboxylicacid, 4-(1-oxo-3-buten-1-yl)-, 9H-fluoren-9-ylmethyl ester
- 1-Piperazinecarboxylicacid, 4-(2-aminophenyl)-, 1,1-dimethylethyl ester
- 914349-54-5Benzoic acid,2-[(4-ethyl-1-piperazinyl)methyl]-
- 914349-55-6Pyridine,3-(3-bromo-4-methoxyphenyl)-
- 914349-58-9Benzaldehyde,4-[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-
- 914349-61-4Benzenemethanol,2-[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-
- 914349-62-5Benzenemethanol, 4-[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-
- 914349-63-6Benzenamine,4-[[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]methyl]-
- 914349-64-7Piperazine,1-[bis(4-fluorophenyl)methyl]-4-[(4-nitrophenyl)methyl]-
- 914349-65-8Benzenamine,4-[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-
- 914349-66-93-NAPHTHALEN-1-YL-THIOMORPHOLINE
- 914349-69-2Pyrimidine, 4-chloro-2-methyl-6-(1-pyrrolidinyl)-
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| Name |
1-Piperazinecarboxylicacid, 4-[(2-carboxyphenyl)methyl]-, 1-(1,1-dimethylethyl) ester |
EINECS | N/A |
| CAS No. | 914349-53-4 | Density | 1.201g/cm3 |
| PSA | 70.08000 | LogP | 2.31330 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C17H24N2O4 | Boiling Point | 445.8 °C at 760 mmHg |
| Molecular Weight | 320.3835 | Flash Point | 223.4 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
1-Boc-4-(2-carboxybenzyl)piperazine; |
1-Piperazinecarboxylicacid, 4-[(2-carboxyphenyl)methyl]-, 1-(1,1-dimethylethyl) ester Specification
The 1-Piperazinecarboxylicacid, 4-[(2-carboxyphenyl)methyl]-, 1-(1,1-dimethylethyl) ester, with CAS registry number 914349-53-4, has the systematic name of 2-[(4-tert-butoxycarbonylpiperazin-1-yl)methyl]benzoic acid. And the chemical formula of this chemical is C17H24N2O4.
Physical properties of 1-Piperazinecarboxylicacid, 4-[(2-carboxyphenyl)methyl]-, 1-(1,1-dimethylethyl) ester: (1)ACD/LogP: 2.16; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.37; (4)#H bond acceptors: 6; (5)#H bond donors: 1; (6)#Freely Rotating Bonds: 5; (7)Polar Surface Area: 70.08 Å2; (8)Index of Refraction: 1.562; (9)Molar Refractivity: 86.49 cm3; (10)Molar Volume: 266.5 cm3; (11)Polarizability: 34.28 10-24cm3; (12)Surface Tension: 50.2 dyne/cm; (13)Enthalpy of Vaporization: 74.18 kJ/mol; (14)Vapour Pressure: 9.93E-09 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)(C)OC(=O)N1CCN(CC1)Cc2ccccc2C(=O)O
(2)InChI: InChI=1/C17H24N2O4/c1-17(2,3)23-16(22)19-10-8-18(9-11-19)12-13-6-4-5-7-14(13)15(20)21/h4-7H,8-12H2,1-3H3,(H,20,21)
(3)InChIKey: WXSZBPULTHYGJD-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C17H24N2O4/c1-17(2,3)23-16(22)19-10-8-18(9-11-19)12-13-6-4-5-7-14(13)15(20)21/h4-7H,8-12H2,1-3H3,(H,20,21)
(5)Std. InChIKey: WXSZBPULTHYGJD-UHFFFAOYSA-N
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