CAS No.1492-11-1,AC-LEU-OME Suppliers

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Basic Information

Molecular Structure:
CAS No.:	1492-11-1
Name:	AC-LEU-OME
Article Data:	25

Formula:	C₉H₁₇NO₃
Molecular Weight:	187.239
Synonyms:	Leucine, N-acetyl-, methyl ester, L-;
Density:	0.999 g/cm³
Boiling Point:	291.7 °C at 760 mmHg
Flash Point:	130.2 °C
PSA:	55.40000
LogP:	1.10110

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Specification

The L-Leucine, N-acetyl-,methyl ester, with the CAS registry number of 1492-11-1, is also known as Leucine, N-acetyl-, methyl ester, L-. It belongs to the product category of Amino Acids. Its molecular formula is C₉H₁₇NO₃ and molecular weight is 187.24. What's more, its systematic name is Methyl N-acetyl-L-leucinate.

Physical properties about the L-Leucine, N-acetyl-,methyl ester are: (1)ACD/LogP: 0.69; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.69; (4)ACD/LogD (pH 7.4): 0.69; (5)ACD/BCF (pH 5.5): 1.96; (6)ACD/BCF (pH 7.4): 1.96; (7)ACD/KOC (pH 5.5): 56.36; (8)ACD/KOC (pH 7.4): 56.36; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 46.61 Å²; (13)Index of Refraction: 1.436; (14)Molar Refractivity: 49.06 cm³; (15)Molar Volume: 187.2 cm³; (16)Surface Tension: 31.2 dyne/cm; (17)Density: 0.999 g/cm³; (18)Flash Point: 130.2 °C; (19)Enthalpy of Vaporization: 53.11 kJ/mol; (20)Boiling Point: 291.7 °C at 760 mmHg; (21)Vapour Pressure: 0.00192 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(N[C@H](C(=O)OC)CC(C)C)C
(2) InChI: InChI=1/C9H17NO3/c1-6(2)5-8(9(12)13-4)10-7(3)11/h6,8H,5H2,1-4H3,(H,10,11)/t8-/m0/s1
(3) InChIKey: IIGAKARAJMXVOZ-QMMMGPOBBD