tert-Butyl L-prolinate supplier

Name
H-PRO-OTBU
EINECS 220-558-0
CAS No. 2812-46-6
Article Data40
CAS DataBase
Density 0.995 g/cm³
Solubility
Melting Point 98-103°C
Formula C₉H₁₇NO₂
Boiling Point 219.2 °C at 760 mmHg
Molecular Weight 171.239
Flash Point 86.4 °C
Transport Information
Appearance Oil
Safety 26-36/37/39-45
Risk Codes 22-37/38-41
Molecular Structure
Hazard Symbols Xn
Synonyms Prolinetert-butyl ester (6CI);Proline, tert-butyl ester, L- (7CI,8CI);(S)-2-(tert-Butoxycarbonyl)pyrrolidine;(S)-Proline tert-butyl ester;1,1-Dimethylethyl L-prolinate;L-Proline tert-butyl ester;tert-Butyl(2S)-2-pyrrolidinecarboxylate;tert-Butyl (S)-pyrrolidine-2-carboxylate;H-Pro-OtBu;
PSA 38.33000
LogP 1.40890

tert-Butyl L-prolinate Chemical Properties

Molecular Structure of L-Proline,1,1-dimethylethyl ester (CAS No. 2812-46-6):

IUPAC Name: tert-Butyl pyrrolidine-2-carboxylate
Synonyms: L-Proline tert-butyl ester ; tert-Butyl L-prolinate
Molecular Formula: C₉H₁₇NO₂
Molecular Weight: 171.24
CAS Registry Number: 2812-46-6
Appearance: Oil
Melting Point: 98-103°C
Storage Temp.: 2-8°C
Index of Refraction: 1.454
Molar Refractivity: 46.6 cm³
Molar Volume: 171.9 cm³
Surface Tension: 31.9 dyne/cm
Density: 0.995 g/cm³
Flash Point: 86.4 °C
Enthalpy of Vaporization: 45.56 kJ/mol
Boiling Point: 219.2 °C at 760 mmHg
Vapour Pressure: 0.121 mmHg at 25°C
EINECS: 220-558-0
Product Categories: Proline [Pro, P];Amino Acids and Derivatives;Amino Acids;I - Z;Modified Amino Acids
Structure Descriptors of L-Proline,1,1-dimethylethyl ester (CAS No. 2812-46-6):
SMILES: O=C(OC(C)(C)C)C1NCCC1
InChI: InChI=1/C9H17NO2/c1-9(2,3)12-8(11)7-5-4-6-10-7/h7,10H,4-6H2,1-3H3
InChIKey: XJJBXZIKXFOMLP-UHFFFAOYAD
Std. InChI: InChI=1S/C9H17NO2/c1-9(2,3)12-8(11)7-5-4-6-10-7/h7,10H,4-6H2,1-3H3
Std. InChIKey: XJJBXZIKXFOMLP-UHFFFAOYSA-N

tert-Butyl L-prolinate Safety Profile

Safety Information of L-Proline,1,1-dimethylethyl ester (CAS No. 2812-46-6):
Hazard Codes: Xn Harmful
Risk Statements: 22-37/38-41
R22:Harmful if swallowed.
R37/38:Irritating to respiratory system and skin.
R41:Risk of serious damage to the eyes.
Safety Statements: 26-36/37/39-45
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection.
S45:In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
WGK Germany: 3

Product Name

H-PRO-OTBU

tert-Butyl L-prolinate Chemical Properties

tert-Butyl L-prolinate Safety Profile

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