(R)-(-)-N-Boc-3-pyrrolidinol supplier

Name
(R)-(-)-N-Boc-3-pyrrolidinol
EINECS
CAS No. 109431-87-0
Article Data3
CAS DataBase
Density 1.142 g/cm³
Solubility
Melting Point 62-65 °C(lit.)
Formula C₉H₁₇NO₃
Boiling Point 273.3 °C at 760 mmHg
Molecular Weight 187.239
Flash Point 119.1 °C
Transport Information
Appearance White to off-white powder
Safety 26-36
Risk Codes 36/37/38-53-50
Molecular Structure
Hazard Symbols Xi
Synonyms 1-Pyrrolidinecarboxylicacid, 3-hydroxy-, 1,1-dimethylethyl ester, (R)-;(3R)-1-(tert-Butoxycarbonyl)-3-hydroxypyrrolidine;(R)-(-)-N-(tert-Butoxycarbonyl)-3-hydroxypyrrolidine;(R)-1-(tert-Butoxycarbonyl)-3-hydroxypyrrolidine;(R)-1-Boc-3-hydroxypyrrolidine;(R)-3-Hydroxy-1-tert-butoxycarbonylpyrrolidine;(R)-3-Hydroxypyrrolidine-1-carboxylic acid tert-butyl ester;(R)-N-(t-Butyloxycarbonyl)-3-hydroxypyrrolidine;(R)-N-Boc-3-hydroxypyrrolidine;1,1-Dimethylethyl(3R)-3-hydroxy-1-pyrrolidinecarboxylate;N-(tert-Butoxycarbonyl)-(R)-(-)-3-pyrrolidinol;N-Boc-(R)-(-)-3-pyrrolidinol;
PSA 49.77000
LogP 0.92600

(R)-(-)-N-Boc-3-pyrrolidinol Specification

The CAS register number of (R)-N-Boc-3-pyrrolidinol is 109431-87-0. It also can be called as N-tert-Butoxycarbonyl-(R)-(-)-3-pyrrolidinol and the IUPAC name about this chemical is tert-butyl (3R)-3-hydroxypyrrolidine-1-carboxylate. The molecular formula about this chemical is C₉H₁₇NO₃and the molecular weight is 187.24. It belongs to the following product categories, such as Pharmacetical; Benzenes; Chiral Building Blocks; Simple Alcohols (Chiral); Synthetic Organic Chemistry; Chiral chemicals and so on. This chemical is stable under normal temperature and pressure, if you want to store it, please keep it in a closed, cool and dry container, you also need avoid contact with strong oxidizing agents.

Physical properties about (R)-N-Boc-3-pyrrolidinol are: (1)ACD/LogP: -0.08; (2)ACD/LogD (pH 5.5): -0.08; (3)ACD/LogD (pH 7.4): -0.08; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 21.66; (7)ACD/KOC (pH 7.4): 21.66; (8)#H bond acceptors: 4; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 38.77Å²; (12)Index of Refraction: 1.502; (13)Molar Refractivity: 48.41 cm³; (14)Molar Volume: 163.9 cm³; (15)Polarizability: 19.19x10^-24cm³; (16)Surface Tension: 44.7 dyne/cm; (17)Enthalpy of Vaporization: 59.4 kJ/mol; (18)Boiling Point: 273.3 °C at 760 mmHg; (19)Vapour Pressure: 0.000742 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is very toxic to aquatic organisms and it is irritating to eyes, respiratory system and skin, it may cause long-term adverse effects in the aquatic environment. When you are using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC(C)(C)C)N1CC[C@@H](O)C1
(2)InChI: InChI=1/C9H17NO3/c1-9(2,3)13-8(12)10-5-4-7(11)6-10/h7,11H,4-6H2,1-3H3/t7-/m1/s1
(3)InChIKey: APCBTRDHCDOPNY-SSDOTTSWBK
(4)Std. InChI: InChI=1S/C9H17NO3/c1-9(2,3)13-8(12)10-5-4-7(11)6-10/h7,11H,4-6H2,1-3H3/t7-/m1/s1
(5)Std. InChIKey: APCBTRDHCDOPNY-SSDOTTSWSA-N

Product Name

(R)-(-)-N-Boc-3-pyrrolidinol

(R)-(-)-N-Boc-3-pyrrolidinol Specification

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