4-Pyrimidinecarboxylicacid, hexahydro-2, 6-dioxo- supplier

Name
2,6-dioxo-hexahydro-pyrimidine-4-carboxylic acid
EINECS
CAS No. 155-54-4
Density 1.523 g/cm³
Solubility
Melting Point 247-249 °C
Formula C₅H₆N₂O₄
Boiling Point
Molecular Weight 158.114
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Acide 2, 6-dioxohexahydro-4-pyrimidinecarboxylique;
PSA 95.50000
LogP -0.67330

4-Pyrimidinecarboxylicacid, hexahydro-2, 6-dioxo- Specification

The 4-Pyrimidinecarboxylicacid, hexahydro-2, 6-dioxo-, with the CAS registry number 155-54-4, is also known as Acide 2, 6-dioxohexahydro-4-pyrimidinecarboxylique. This chemical's molecular formula is C₅H₆N₂O₄ and molecular weight is 158.1121. What's more, its systematic name is 2, 6-Dioxohexahydropyrimidine-4-carboxylic acid.

Physical properties about 4-Pyrimidinecarboxylicacid, hexahydro-2, 6-dioxo- are: (1)ACD/LogP: -1.30; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.65; (4)ACD/LogD (pH 7.4): -4.93; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 6; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 66.92 Å²; (13)Index of Refraction: 1.519; (14)Molar Refractivity: 31.51 cm³; (15)Molar Volume: 103.7 cm³; (16)Polarizability: 12.49×10^-24 cm³; (17)Surface Tension: 59 dyne/cm; (18)Density: 1.523 g/cm³.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C1NC(=O)NC(C(=O)O)C1
(2) InChI: InChI=1/C5H6N2O4/c8-3-1-2(4(9)10)6-5(11)7-3/h2H,1H2,(H,9,10)(H2,6,7,8,11)
(3) InChIKey: UFIVEPVSAGBUSI-UHFFFAOYAI

Product Name

2,6-dioxo-hexahydro-pyrimidine-4-carboxylic acid

4-Pyrimidinecarboxylicacid, hexahydro-2, 6-dioxo- Specification

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