(3R,4R)-4-Isopropylpyrrolidine-3-carboxylic acid supplier

Name
3-Pyrrolidinecarboxylicacid,4-(1-methylethyl)-,(3R,4R)-rel-(9CI)
EINECS
CAS No. 261896-36-0
Density 1.054 g/cm³
Solubility
Melting Point
Formula C₈H₁₅NO₂
Boiling Point 270.829 °C at 760 mmHg
Molecular Weight 157.213
Flash Point 117.594 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms (3R,4R)-4-Isopropylpyrrolidine-3-carboxylic acid;
PSA 49.33000
LogP 0.89140

(3R,4R)-4-Isopropylpyrrolidine-3-carboxylic acid Specification

The (3R,4R)-4-Isopropylpyrrolidine-3-carboxylic acid with the cas number 261896-36-0 is also called 3-Pyrrolidinecarboxylicacid, 4-(1-methylethyl)-, (3R,4R)-rel-. The systematic name is (3R,4R)-4-(propan-2-yl)pyrrolidine-3-carboxylic acid. Its molecular formula is C₈H₁₅NO₂. This chemical belongs to the following product categories: (1)isopropyl; (2)carboxylicacid.

The properties of the chemical are: (1)ACD/LogP: 1.06; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 49.33 Å²; (7)Index of Refraction: 1.472; (8)Molar Refractivity: 41.767 cm³; (9)Molar Volume: 149.108 cm³; (10)Polarizability: 16.558×10^-24cm³; (11)Surface Tension: 35.964 dyne/cm; (12)Enthalpy of Vaporization: 56.027 kJ/mol; (13)Vapour Pressure: 0.002 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@H]1CNC[C@@H]1C(C)C
(2)InChI: InChI=1/C8H15NO2/c1-5(2)6-3-9-4-7(6)8(10)11/h5-7,9H,3-4H2,1-2H3,(H,10,11)/t6-,7+/m1/s1
(3)InChIKey: NQULSPPHDFWDLL-RQJHMYQMBH

Product Name

3-Pyrrolidinecarboxylicacid,4-(1-methylethyl)-,(3R,4R)-rel-(9CI)

(3R,4R)-4-Isopropylpyrrolidine-3-carboxylic acid Specification

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