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N-Formyl-L-leucine

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Name

N-Formyl-L-leucine

EINECS 228-080-4
CAS No. 6113-61-7 Density 1.093 g/cm3
PSA 66.40000 LogP 1.25850
Solubility 29.45g/L(temperature not stated) Melting Point 142 °C
Formula C7H13NO3 Boiling Point 360.649 °C at 760 mmHg
Molecular Weight 159.185 Flash Point 171.915 °C
Transport Information N/A Appearance white powder
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 6113-61-7 (N-FORMYL-L-LEUCINE) Hazard Symbols N/A
Synonyms

Leucine,N-formyl-, L- (8CI);(S)-(+)-2-Formamido-4-methylpentanoic acid;N-Formyl-L-leucine;N-Formyl-S-leucine;N-Formylleucine;NSC 334321;

Article Data 14

N-Formyl-L-leucine Specification

The CAS register number of N-Formyl-L-leucine is 6113-61-7. It also can be called as L-Leucine, N-formyl- and the IUPAC name about this chemical is 2-formamido-4-methylpentanoic acid. It belongs to the following product categories, such as Aminoacids derivatives, Amino Acids 13C, 2H, 15N, Amino Acids & Derivatives, Chiral Reagents, A - H, Amino Acids, Modified Amino Acids and so on. This chemical can be used as a synthetic substrate of the lipase inhibitor lipstatin.

Physical properties about N-Formyl-L-leucine are: (1)ACD/LogP: -0.67; (2)ACD/LogD (pH 5.5): -1; (3)ACD/LogD (pH 7.4): -3; (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: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 66.4Å2; (12)Index of Refraction: 1.458; (13)Molar Refractivity: 39.743 cm3; (14)Molar Volume: 145.596 cm3; (15)Polarizability: 15.755x10-24cm3; (16)Surface Tension: 39.087 dyne/cm; (17)Enthalpy of Vaporization: 66.609 kJ/mol; (18)Boiling Point: 360.649 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@@H](NC=O)CC(C)C
(2)InChI: InChI=1/C7H13NO3/c1-5(2)3-6(7(10)11)8-4-9/h4-6H,3H2,1-2H3,(H,8,9)(H,10,11)/t6-/m0/s1
(3)InChIKey: HFBHOAHFRNLZGN-LURJTMIEBZ
(4)Std. InChI: InChI=1S/C7H13NO3/c1-5(2)3-6(7(10)11)8-4-9/h4-6H,3H2,1-2H3,(H,8,9)(H,10,11)/t6-/m0/s1
(5)Std. InChIKey: HFBHOAHFRNLZGN-LURJTMIESA-N

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