Products Categories
| CAS No.: | 496-76-4 |
|---|---|
| Name: | ISOBARBITURIC ACID |
| Molecular Structure: | |
|
|
|
| Formula: | C4H4N2O3 |
| Molecular Weight: | 128.087 |
| Synonyms: | Isobarbituricacid (6CI,7CI,8CI);NSC 95958; |
| EINECS: | 207-829-9 |
| Density: | 1.455g/cm3 |
| Melting Point: | >300 °C (dec.)(lit.) |
| Boiling Point: | 534.5oC at 760mmHg |
| Flash Point: | 277oC |
| Hazard Symbols: | R36/37/38:Irritating to eyes, respiratory system and skin.; |
| Risk Codes: | Xi:Irritant; ">  Xi:Irritant; |
| Safety: | 26-36 |
| PSA: | 85.95000 |
| LogP: | -1.23120 |
- 5156-58-1N-(1-Benzyl-4-pipperidinyl)-N-phenylpropanamide HCl
- 81281-59-67-Benzylideneaminotheophylline
- 50288-62-5threo-Phenyl-2-piperidyl acetamide
- 82993-81-5D-threo-Ritalinic acid hydrochloride
- 73441-42-6METHYL-5-CHLORO-2,2-DIMETHYLVALERATE
- 68439-39-4Poly(oxy-1,2-ethanediyl), alpha-(2-ethylhexyl)-omega-hydroxy-,
- 852475-26-4MC1568
- 958254-66-51H-Imidazo[4,5-b]pyridine-2-carboxaldehyde, 1-methyl-, hydrochloride
- 99170-93-1N-Methyl-2-oxazolamine
- 717878-06-31-(4-fluorophenyl)-4-nitro-1H-imidazole
- 497181-27-83,5-Dibromo-2-fluorobenzyl alcohol
- 49719-60-0tris(2-hydroxyethyl)ammonium palmitate
- 497-25-62-Oxazolidone
- 497-37-0EXO-NORBORNEOL
- 49745-25-7Carbonic acid, monomethyl ester, ion(1-)
- 49754-15-6Diethyl malonyldicarbamate
- 49773-20-82-Aminoethylmethyl sulfone
- 497926-97-3POLYIMIDE-1
- 104987-11-3Tacrolimus
- 141-53-7Sodium formate
- 8001-54-5Quaternary ammonium compounds, alkylbenzyldimethyl, chlorides
- 9003-39-8Povidone
- 10161-34-9Trenbolone acetate
- 402957-28-2Telaprevir
- 68-19-9Cyanocobalamin
- Total:34 Page 1 of 1 1
What can I do for you?
Get Best Price
Specification
The 2,4,5(3H)-Pyrimidinetrione,dihydro-, with the CAS registry number 496-76-4, has the systematic name of dihydropyrimidine-2,4,5(3H)-trione. It is also called 1,3-diazinane-2,4,5-trione. And the molecular formula of the chemical is C4H4N2O3.
The characteristics of 2,4,5(3H)-Pyrimidinetrione,dihydro- are as followings: (1)ACD/LogP: -1.74; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.74; (4)ACD/LogD (pH 7.4): -1.94; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 2.68; (8)ACD/KOC (pH 7.4): 1.68; (9)#H bond acceptors: 5; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 57.69 Å2; (13)Index of Refraction: 1.492; (14)Molar Refractivity: 25.53 cm3; (15)Molar Volume: 88 cm3; (16)olarizability: 10.12×10-24cm3; (17)Surface Tension: 48.7 dyne/cm; (18)Density: 1.455 g/cm3.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C1C(=O)NC(=O)NC1
(2)InChI: InChI=1/C4H4N2O3/c7-2-1-5-4(9)6-3(2)8/h1H2,(H2,5,6,8,9)
(3)InChIKey: FQXOOGHQVPKHPG-UHFFFAOYAA