Products Categories
| CAS No.: | 20271-20-9 |
|---|---|
| Name: | 1H-Imidazole-4-carboxylic acid, 5-nitro-, methyl ester |
| Article Data: | 4 |
| Molecular Structure: | |
|
|
|
| Formula: | C5H5N3O4 |
| Molecular Weight: | 171.112 |
| Synonyms: | 5-Imidazolic acid, 4-nitro-, methyl ester; |
| Density: | 1.545 g/cm3 |
| Melting Point: | 212-213 °C |
| Boiling Point: | 409.7 °C at 760 mmHg |
| Flash Point: | 201.6 °C |
| PSA: | 100.80000 |
| LogP: | 0.62770 |
- 483366-12-7(2S,4R)-1-Boc-2-cyano-4-hydroxypyrrolidine
- 361456-36-2METHYL (R)-(+)-ISOCYANATO-3-PHENYLPROPI&
- 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
- 47087-37-6Z-D-Glu-OMe
- 73441-42-6METHYL-5-CHLORO-2,2-DIMETHYLVALERATE
- 211914-50-0N-[[2-[[[4-(Aminoiminomethyl)phenyl]amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl]-N-(2-pyridinyl)-beta-alanine ethyl ester hydrochloride
- 240444-70-62,3,5,6-Tetrafluor-4-(methoxymethyl)benzyl-2,2-dimethyl-3-(prop-1-en-1-yl)cyclopropancarboxylat
- Total:15 Page 1 of 1 1
What can I do for you?
Get Best Price
Specification
The 1H-Imidazole-4-carboxylicacid, 5-nitro-, methyl ester, with the CAS registry number 20271-20-9, is also known as 5-Imidazolic acid, 4-nitro-, methyl ester. This chemical's molecular formula is C5H5N3O4 and molecular weight is 171.1109. What's more, its systematic name are is called Methyl 4-nitro-1H-imidazole-5-carboxylate.
Physical properties about 1H-Imidazole-4-carboxylicacid, 5-nitro-, methyl ester are: (1)ACD/LogP: -0.13; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.23; (4)ACD/LogD (pH 7.4): -1.4; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 15.97; (8)ACD/KOC (pH 7.4): 1.08; (9)#H bond acceptors: 7; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 89.94Å2; (13)Index of Refraction: 1.584; (14)Molar Refractivity: 37.09 cm3; (15)Molar Volume: 110.7 cm3; (16)Polarizability: 14.7×10-24 cm3; (17)Surface Tension: 70.9 dyne/cm; (18)Density: 1.545 g/cm3; (19)Flash Point: 201.6 °C; (20)Enthalpy of Vaporization: 66.19 kJ/mol; (21)Boiling Point: 409.7 °C at 760 mmHg; (22)Vapour Pressure: 6.38E-07 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=[N+]([O-])c1ncnc1C(=O)OC
(2) InChI: InChI=1/C5H5N3O4/c1-12-5(9)3-4(8(10)11)7-2-6-3/h2H,1H3,(H,6,7)
(3) InChIKey: YGTWILAKCGDEML-UHFFFAOYAH