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| Name |
Diazoacetylglycine ethyl ester |
EINECS | N/A |
| CAS No. | 999-29-1 | Density | g/cm3 |
| PSA | 92.79000 | LogP | -0.56174 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C6H9 N3 O3 | Boiling Point | °Cat760mmHg |
| Molecular Weight | 171.156 | Flash Point | °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Moderately toxic by intraperitoneal route. Mutation data reported. When heated to decomposition it emits toxic fumes of NOx. See also ESTERS. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Diazoacetylglycineethyl ester; Ethyl diazoacetylglycinate; N-(Diazoacetyl)glycine ethyl ester;NSC 58406 |
Diazoacetylglycine ethyl ester Chemical Properties
Molecule structure of Diazoacetylglycine ethyl ester (CAS NO.999-29-1):
IUPAC Name: 2-Diazonio-1-[(2-ethoxy-2-oxoethyl)amino]ethenolate
Molecular Weight: 171.15396 g/mol
Molecular Formula: C6H9N3O3
XLogP3-AA: 1.9
H-Bond Donor: 1
H-Bond Acceptor: 5
Rotatable Bond Count: 5
Exact Mass: 171.064391
MonoIsotopic Mass: 171.064391
Topological Polar Surface Area: 89.5
Heavy Atom Count: 12
Complexity: 227
Canonical SMILES: CCOC(=O)CNC(=C[N+]#N)[O-]
InChI: InChI=1S/C6H9N3O3/c1-2-12-6(11)4-8-5(10)3-9-7/h3,8H,2,4H2,1H3
InChIKey: FCWKFVYNIGDHQM-UHFFFAOYSA-N
Classification Code of Diazoacetylglycine ethyl ester (CAS NO.999-29-1): mutation data
Diazoacetylglycine ethyl ester Toxicity Data With Reference
| 1. | mmo-sat 10 µg/plate | AMACCQ Antimicrobial Agents and Chemotherapy. 6 (1974),655. | ||
| 2. | dns-mus:fbr 2500 mmol/L | JCROD7 Journal of Cancer Research and Clinical Oncology. 94 (1979),7. | ||
| 3. | ipr-mus LD50:1149 mg/kg | ARZNAD Arzneimittel-Forschung. Drug Research. 23 (1973),690. |
Diazoacetylglycine ethyl ester Consensus Reports
EPA Genetic Toxicology Program.
Diazoacetylglycine ethyl ester Safety Profile
Moderately toxic by intraperitoneal route. Mutation data reported. When heated to decomposition it emits toxic fumes of NOx. See also ESTERS.
Diazoacetylglycine ethyl ester Specification
Diazoacetylglycine ethyl ester (CAS NO.999-29-1) is also named as Ethyl diazoacetylglycinate ; AI3-52379 ; CCRIS 928 ; M 405 ; N-Diazoacetylglycine ethyl ester ; NSC 58406 ; O-Ethyl N-diazoacetylglycine ; Glycine, N-(diazoacetyl)-, ethyl ester ; N-Diazoacetylglycine ethyl ester .
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