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Glycine,N-acetylglycyl-L-histidyl-

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Name

Glycine,N-acetylglycyl-L-histidyl-

EINECS N/A
CAS No. 3654-95-3 Density 1.5 g/cm3
PSA 153.28000 LogP -1.05340
Solubility N/A Melting Point N/A
Formula C12H17N5O5 Boiling Point N/A
Molecular Weight 311.30 Flash Point N/A
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 3654-95-3 (N-acetylglycyl-histidyl-glycine) Hazard Symbols N/A
Synonyms

Glycine,N-[N-(N-acetylglycyl)-L-histidyl]- (7CI,8CI);

 

Glycine,N-acetylglycyl-L-histidyl- Specification

The Glycine, N-acetylglycyl-L-histidyl-, with the CAS registry number 3654-95-3, is also known as Glycine, N-[N-(N-acetylglycyl)-L-histidyl]- (7CI, 8CI). This chemical's molecular formula is C12H17N5O5 and molecular weight is 311.30. What's more, its systematic name is N-Acetylglycyl-3-(4H-imidazol-4-yl)-L-alanylglycine.

Physical properties about Glycine, N-acetylglycyl-L-histidyl- are: (1)ACD/LogP: -2.19; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 10; (4)#H bond donors: 4; (5)#Freely Rotating Bonds: 8; (6)Polar Surface Area: 111.95 Å2; (7)Index of Refraction: 1.642; (8)Molar Refractivity: 74.64 cm3; (9)Molar Volume: 206.4 cm3; (10)Polarizability: 29.59×10-24 cm3; (11)Surface Tension: 63.4 dyne/cm; (12)Density: 1.5 g/cm3.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(O)CNC(=O)[C@@H](NC(=O)CNC(=O)C)CC/1/N=C\N=C\1
(2) InChI: InChI=1/C12H17N5O5/c1-7(18)14-4-10(19)17-9(2-8-3-13-6-16-8)12(22)15-5-11(20)21/h3,6,8-9H,2,4-5H2,1H3,(H,14,18)(H,15,22)(H,17,19)(H,20,21)/t8?,9-/m0/s1
(3) InChIKey: GLPFVICFSGSZMF-GKAPJAKFBY

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