CAS No.59785-68-1,AC-D-PRO-OH Suppliers

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Basic Information

Molecular Structure:
CAS No.:	59785-68-1
Name:	AC-D-PRO-OH
Article Data:	1

Formula:	C₇H₁₁NO₃
Molecular Weight:	157.169
Synonyms:	(R)-(+)-N-Acetylproline;(R)-1-Acetyl-2-pyrrolidinecarboxylic acid;N-Acetyl-D-proline;
EINECS:	826-011-8
Density:	1.274g/cm³
Boiling Point:	366.2 °C at 760 mmHg
Flash Point:	175.3 °C
Hazard Symbols:	Xn
Risk Codes:	22
PSA:	57.61000
LogP:	0.01980

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Specification

The D-Proline, 1-acetyl-, with CAS registry number 59785-68-1, belongs to the following product categories: (1)Acetylgroup; (2)Pyrrole ; (3)Amino Acids. It has the systematic name of 1-acetyl-D-proline. This chemical should be stored at room temperature. And the chemical formula of this chemical is C₇H₁₁NO₃.

Physical properties of D-Proline, 1-acetyl-: (1)ACD/LogP: -0.77; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 4; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 46.61 Å²; (11)Index of Refraction: 1.517; (12)Molar Refractivity: 37.32 cm³; (13)Molar Volume: 123.2 cm³; (14)Polarizability: 14.79×10^-24cm³; (15)Surface Tension: 52.8 dyne/cm; (16)Density: 1.274 g/cm³; (17)Flash Point: 175.3 °C; (18)Enthalpy of Vaporization: 67.28 kJ/mol; (19)Boiling Point: 366.2 °C at 760 mmHg; (20)Vapour Pressure: 2.31E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@@H]1N(C(=O)C)CCC1
(2)InChI: InChI=1/C7H11NO3/c1-5(9)8-4-2-3-6(8)7(10)11/h6H,2-4H2,1H3,(H,10,11)/t6-/m1/s1
(3)InChIKey: GNMSLDIYJOSUSW-ZCFIWIBFBC
(4)Std. InChI: InChI=1S/C7H11NO3/c1-5(9)8-4-2-3-6(8)7(10)11/h6H,2-4H2,1H3,(H,10,11)/t6-/m1/s1
(5)Std. InChIKey: GNMSLDIYJOSUSW-ZCFIWIBFSA-N