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Cas Database |
| Name |
Dimethyl 2-diazomalonate |
EINECS | N/A |
| CAS No. | 6773-29-1 | Density | N/A |
| PSA | N/A | LogP | N/A |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C5H6N2O4 | Boiling Point | 50-52 °C(Press: 1 Torr) |
| Molecular Weight | 158.114 | Flash Point | N/A |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Malonicacid, diazo-, dimethyl ester (7CI,8CI);Propanedioic acid, diazo-, dimethylester (9CI);Bis(methoxycarbonyl)diazomethane;Diazodimethylmalonate;Diazomalonic acid dimethyl ester;Diazomalonic acid methyl ester;Diazopropanedioic acid dimethyl ester;Dicarbomethoxydiazomethane;Dimethyl2-diazomalonate;Dimethyl diazomalonate;Methyl diazomalonate;NSC 138651; |
Article Data | 91 |
Dimethyl 2-diazomalonate Specification
The cas register number of Dimethyl 2-diazomalonate is 6773-29-1. It also can be called as 2-Diazopropanedioic acid 1,3-dimethyl ester and the IUPAC Name about this chemical is 2-diazonio-1,3-dimethoxy-3-oxoprop-1-en-1-olate.
Physical properties about Dimethyl 2-diazomalonate are: (1)#H bond acceptors: 6; (2)#H bond donors: 1; (3)#Freely Rotating Bonds: 5; (4)XLogP3-AA: 1.7; (5)H-Bond Acceptor: 5; (6)Rotatable Bond Count: 3; (7)Exact Mass: 158.032757; (8)MonoIsotopic Mass: 158.032757; (9)Topological Polar Surface Area: 86.7; (10)Heavy Atom Count: 11; (11)Complexity: 219; (12)Undefined Bond StereoCenter Count: 1; (13)Covalently-Bonded Unit Count 1; (14)Polar Surface Area: 83.91Å2.
You can still convert the following datas into molecular structure:
(1)SMILES: N#[N+]C(C(=O)OC)=C([O-])OC
(2)InChI: InChI=1/C5H6N2O4/c1-10-4(8)3(7-6)5(9)11-2/h1-2H3
(3)InChIKey: UFAZHCVBGMSJHS-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C5H6N2O4/c1-10-4(8)3(7-6)5(9)11-2/h1-2H3
(5)Std. InChIKey: UFAZHCVBGMSJHS-UHFFFAOYSA-N
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