Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
(S)-(-)-1-cbz-2-piperidinecarboxylic acid |
EINECS | N/A |
CAS No. | 28697-11-2 | Density | 1.265 g/cm3 |
PSA | 66.84000 | LogP | 2.20020 |
Solubility | N/A | Melting Point |
111-115 °C(lit.) |
Formula | C14H17NO4 | Boiling Point | 443.922 °C at 760 mmHg |
Molecular Weight | 263.293 | Flash Point | 222.276 °C |
Transport Information | N/A | Appearance | white to light yellow crystal powder |
Safety | 26-36 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
1,2-Piperidinedicarboxylicacid, 1-(phenylmethyl) ester, (2S)-;1,2-Piperidinedicarboxylic acid, 1-benzylester, L- (8CI);(-)-1-Carbobenzyloxy-2-piperidinecarboxylic acid;(2S)-1-(Carbobenzyloxy)-2-piperidinecarboxylic acid;(2S)-1-[(Benzyloxy)carbonyl]hexahydro-2-pyridinecarboxylic acid;(S)-1-Benzyloxycarbonylpiperidine-2-carboxylic acid;Benzyloxycarbonyl-L-2-piperidinecarboxylicacid;N-Benzyloxycarbonyl-(S)-piperidine-2-carboxylic acid; |
Article Data | 13 |
The (S)-1-N-Cbz-Pipecolinic acid, with the CAS registry number 28697-11-2, is also known as Benzyloxycarbonyl-L-2-piperidinecarboxylicacid. It belongs to the product categories of Chiral; Chiral Building Blocks; Heterocyclic Building Blocks; Piperidines. This chemical's molecular formula is C14H17NO4 and formula weight is 263.29. What's more, its systematic name is (2S)-1-[(benzyloxy)carbonyl]piperidine-2-carboxylic acid.
Physical properties of (S)-1-N-Cbz-Pipecolinic acid are: (1)ACD/LogP: 1.74; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.24; (4)ACD/BCF (pH 5.5): 1; (5)ACD/KOC (pH 5.5): 6.64; (6)#H bond acceptors: 5; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 4; (9)Polar Surface Area: 55.84 Å2; (10)Index of Refraction: 1.568; (11)Molar Refractivity: 68.17 cm3; (12)Molar Volume: 208 cm3; (13)Surface Tension: 55 dyne/cm; (14)Density: 1.265 g/cm3; (15)Flash Point: 222.3 °C; (16)Enthalpy of Vaporization: 73.95 kJ/mol; (17)Boiling Point: 443.9 °C at 760 mmHg; (18)Vapour Pressure: 1.16E-08 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCc1ccccc1)N2[C@H](C(=O)O)CCCC2
(2)InChI: InChI=1S/C14H17NO4/c16-13(17)12-8-4-5-9-15(12)14(18)19-10-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2,(H,16,17)/t12-/m0/s1
(3)InChIKey: ZSAIHAKADPJIGN-LBPRGKRZSA-N