Products Categories
| CAS No.: | 13184-27-5 |
|---|---|
| Name: | CARBAMOYL-ASP-OH MAGNESIUM SALT/CARBAMOYL-ASP-OH DIPOTASSIUM SALT (1:1) |
| Article Data: | 2 |
| Molecular Structure: | |
|
|
|
| Formula: | C5H8N2O5 |
| Molecular Weight: | 176.129 |
| Synonyms: | Asparticacid, N-carbamoyl-, L- (6CI,8CI);Carbamoylaspartic acid;Carbamylasparticacid;L-Ureidosuccinic acid;N-Carbamoyl-(S)-aspartic acid;N-Carbamoyl-L-aspartic acid;N-Carbamoylaspartic acid;N-Carbamylaspartic acid;NSC 14983; |
| EINECS: | 236-134-3 |
| Density: | 1.596 g/cm3 |
| Melting Point: | 174 - 175oC |
| Boiling Point: | 366.4 °C at 760 mmHg |
| Flash Point: | 175.4 °C |
| PSA: | 129.72000 |
| LogP: | -0.32620 |
- 144851-82-1METHYL2-AMINO-3-FLUOROBENZOATE
- 483366-12-7(2S,4R)-1-Boc-2-cyano-4-hydroxypyrrolidine
- 173606-50-3BOC-10-AMINODECANOIC ACID
- 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
- Total:27 Page 1 of 1 1
What can I do for you?
Get Best Price
Specification
The L-Aspartic acid,N-(aminocarbonyl)-, with the CAS registry number 13184-27-5, is also known as Aspartic acid, N-carbamoyl-. This chemical's classification code is Drug / Therapeutic Agent and its EINECS registry number is 236-134-3. This chemical's molecular formula is C5H8N2O5. Its IUPAC name is called (2S)-2-(carbamoylamino)butanedioic acid.
Physical properties of L-Aspartic acid,N-(aminocarbonyl)-: (1)ACD/LogP: -1.23; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -4.4; (4)ACD/LogD (pH 7.4): -5.97; (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: 7; (10)#H bond donors: 5; (11)#Freely Rotating Bonds: 4; (12)Index of Refraction: 1.556; (13)Molar Refractivity: 35.46 cm3; (14)Molar Volume: 110.3 cm3; (15)Surface Tension: 84.1 dyne/cm; (16)Density: 1.596 g/cm3; (17)Flash Point: 175.4 °C; (18)Enthalpy of Vaporization: 67.31 kJ/mol; (19)Boiling Point: 366.4 °C at 760 mmHg; (20)Vapour Pressure: 2.27E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C(C(C(=O)O)NC(=O)N)C(=O)O
(2)Isomeric SMILES: C([C@@H](C(=O)O)NC(=O)N)C(=O)O
(3)InChI: InChI=1S/C5H8N2O5/c6-5(12)7-2(4(10)11)1-3(8)9/h2H,1H2,(H,8,9)(H,10,11)(H3,6,7,12)/t2-/m0/s1
(4)InChIKey: HLKXYZVTANABHZ-REOHCLBHSA-N
The toxicity data is as follows:
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | oral | > 1gm/kg (1000mg/kg) | Khimiko-Farmatsevticheskii Zhurnal. Chemical Pharmaceutical Journal. For English translation, see PCJOAU. Vol. 24(4), Pg. 32, 1990. |