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(2S,4R)-4-Aminopyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester

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Name

(2S,4R)-4-Aminopyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester

EINECS N/A
CAS No. 132622-69-6 Density 1.232 g/cm3
PSA 92.86000 LogP 1.04590
Solubility N/A Melting Point 228-229 °C(Solv: ethanol (64-17-5))
Formula C10H18N2O4 Boiling Point 371.1 °C at 760 mmHg
Molecular Weight 230.264 Flash Point 178.2 °C
Transport Information N/A Appearance N/A
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 132622-69-6 ((2S,4R)-1-BOC-4-AMINO-PYRROLIDINE-2-CARBOXYLIC ACID) Hazard Symbols IrritantXi
Synonyms

1,2-Pyrrolidinedicarboxylicacid, 4-amino-, 1-(1,1-dimethylethyl) ester, (2S-trans)-;

Article Data 9

(2S,4R)-4-Aminopyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester Specification

The (2S,4R)-4-Aminopyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester, its cas register number is 132622-69-6. It also can be called as 1,2-Pyrrolidinedicarboxylicacid, 4-amino-, 1-(1,1-dimethylethyl) ester, (2S,4R)- and the IUPAC name about this chemical is (2S,4R)-4-amino-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-
2-carboxylic acid.

Physical properties about (2S,4R)-4-Aminopyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester are: (1)#H bond acceptors: 6; (2)#H bond donors: 3; (3)#Freely Rotating Bonds: 4; (4)Polar Surface Area: 92.86Å2; (5)Index of Refraction: 1.516; (6)Molar Refractivity: 56.48 cm3; (7)Molar Volume: 186.7 cm3; (8)Polarizability: 22.39x10-24cm3; (9)Surface Tension: 50.1 dyne/cm; (10)Enthalpy of Vaporization: 67.87 kJ/mol; (11)Vapour Pressure: 1.59E-06 mmHg at 25°C

When you are using this chemical, you should be very cautious. Being a kind of irritant chemical, it is irritating to eyes, respiratory system and skin. When you are contacting with it, wear suitable protective clothing. And if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)(C)OC(=O)N1C[C@@H](C[C@H]1C(=O)O)N
(2)InChI: InChI=1/C10H18N2O4/c1-10(2,3)16-9(15)12-5-6(11)4-7(12)8(13)14/h6-7H,4-5,11H2,1-3H3,(H,13,14)/t6-,7+/m1/s1
(3)InChlKey: WDWRIVZIPSHUOR-RQJHMYQMBU
(4)Std. InChI: InChI=1S/C10H18N2O4/c1-10(2,3)16-9(15)12-5-6(11)4-7(12)8(13)14/h6-7H,4-5,11H2,1-3H3,(H,13,14)/t6-,7+/m1/s1
(5)Std. InChIKey: WDWRIVZIPSHUOR-RQJHMYQMSA-N

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