Pentanediamide,2-(acetylamino)-, (2S)- supplier

Name
AC-GLN-NH2
EINECS
CAS No. 18839-88-8
Density 1.231 g/cm³
Solubility
Melting Point
Formula C₇H₁₃N₃O₃
Boiling Point 630.1 °C at 760 mmHg
Molecular Weight 187.2
Flash Point 334.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms N-Acetylglutamine amide;N-Acetyl-L-glutamic acid diamide;Glutaramide,2-acetamido-, L- (8CI);Pentanediamide, 2-(acetylamino)-, (S)-;(2S)-2-(Acetylamino)pentanediamide;
PSA 115.28000
LogP 0.03340

Pentanediamide,2-(acetylamino)-, (2S)- Specification

The Pentanediamide,2-(acetylamino)-, (2S)-, with the CAS registry number 18839-88-8, is also known as (2S)-2-(Acetylamino)pentanediamide. This chemical's molecular formula is C₇H₁₃N₃O₃ and molecular weight is 187.2. What's more, its systematic name is N²-Acetyl-L-glutamamide and its storage temperature is -15 °C.

Physical properties of Pentanediamide,2-(acetylamino)-, (2S)- are: (1)ACD/LogP: -2.45; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -2.45; (4)ACD/LogD (pH 7.4): -2.45; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1.11; (8)ACD/KOC (pH 7.4): 1.11; (9)#H bond acceptors: 6; (10)#H bond donors: 5; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 60.93 Å²; (13)Index of Refraction: 1.506; (14)Molar Refractivity: 45.19 cm³; (15)Molar Volume: 151.9 cm³; (16)Polarizability: 17.91×10^-24cm³; (17)Surface Tension: 52.5 dyne/cm; (18)Density: 1.231 g/cm³; (19)Flash Point: 334.9 °C; (20)Enthalpy of Vaporization: 93.2 kJ/mol; (21)Boiling Point: 630.1 °C at 760 mmHg; (22)Vapour Pressure: 8.73E-16 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(N[C@H](C(=O)N)CCC(=O)N)C
(2)InChI: InChI=1/C7H13N3O3/c1-4(11)10-5(7(9)13)2-3-6(8)12/h5H,2-3H2,1H3,(H2,8,12)(H2,9,13)(H,10,11)/t5-/m0/s1
(3)InChIKey: TWPOMVPGGXUNKI-YFKPBYRVSA-N

Product Name

AC-GLN-NH2

Pentanediamide,2-(acetylamino)-, (2S)- Specification

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