(3S,4S)-Pyrrolidine-3,4-diol supplier

Name
(3S,4S)-Pyrrolidine-3,4-diol
EINECS
CAS No. 90481-32-6
Article Data20
CAS DataBase
Density 1.309 g/cm³
Solubility
Melting Point
Formula C₄H₉NO₂
Boiling Point 232.3 °C at 760 mmHg
Molecular Weight 103.121
Flash Point 144 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3,4-Pyrrolidinediol,(3S-trans)-;(3S,4S)-3,4-Dihydroxypyrrolidine;(S,S)-3,4-Dihydroxypyrrolidine;
PSA 52.49000
LogP -1.35980

(3S,4S)-Pyrrolidine-3,4-diol Specification

The (3S,4S)-Pyrrolidine-3,4-diol is an organic compound with the formula C₄H₉NO₂. The IUPAC name of this chemical is (3S,4S)-pyrrolidine-3,4-diol. With the CAS registry number 90481-32-6, it is also named as 1,4-Dideoxy-1,4-imino-L-threitol.

Physical properties about (3S,4S)-Pyrrolidine-3,4-diol are: (1)ACD/LogP: -1.92; (2)ACD/LogD (pH 5.5): -4.95; (3)ACD/LogD (pH 7.4): -3.86; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 21.7 Å²; (12)Index of Refraction: 1.547; (13)Molar Refractivity: 24.97 cm³; (14)Molar Volume: 78.7 cm³; (15)Polarizability: 9.9×10^-24cm³; (16)Surface Tension: 47.2 dyne/cm; (17)Density: 1.309 g/cm³; (18)Flash Point: 144 °C; (19)Enthalpy of Vaporization: 54.52 kJ/mol; (20)Boiling Point: 232.3 °C at 760 mmHg; (21)Vapour Pressure: 0.0111 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O[C@H]1CNC[C@@H]1O
(2)InChI: InChI=1/C4H9NO2/c6-3-1-5-2-4(3)7/h3-7H,1-2H2/t3-,4-/m0/s1
(3)InChIKey: JCZPOYAMKJFOLA-IMJSIDKUBC
(4)Std. InChI: InChI=1S/C4H9NO2/c6-3-1-5-2-4(3)7/h3-7H,1-2H2/t3-,4-/m0/s1
(5)Std. InChIKey: JCZPOYAMKJFOLA-IMJSIDKUSA-N

Product Name

(3S,4S)-Pyrrolidine-3,4-diol

(3S,4S)-Pyrrolidine-3,4-diol Specification

Related Products

Hot Products