| CAS Number | 758692-47-6 |
| Catalog Number | AG0059V2(AGN-PC-0WQUEA) |
| Chemical Name | Ethyl 2-(4-bromophenyl)-2-diazoacetate |
| IUPAC Name | ethyl 2-(4-bromophenyl)-2-diazoacetate |
| InChI | InChI=1S/C10H9BrN2O2/c1-2-15-10(14)9(13-12)7-3-5-8(11)6-4-7/h3-6H,2H2,1H3 |
| InChI Key | XWVFDRBGXZRGAE-UHFFFAOYSA-N |
| MDL Number | MFCD11042220 |
| Molecular Formula | C10H9BrN2O2 |
| Molecular Weight | 269.0947 |
| SMILES | CCOC(=O)C(=[N+]=[N-])c1ccc(cc1)Br |
| Synonyms | ETHYL 2-(4-BROMOPHENYL)-2-DIAZOACETATE,
758692-47-6,
2-(4-bromophenyl)-2-diazonio-1-ethoxyethenolate,
Benzeneacetic acid,4-bromo-a-diazo-, ethyl ester,
SCHEMBL17338792,
CTK5E2116,
DTXSID50694872,
CE-403,
ZINC40448262,
AKOS015900091,
AN-27302,
DB-014312,
X7012,
2-(4-bromophenyl)-2-diazonio-1-ethoxy-ethenolate,
A838536,
2-(4-Bromophenyl)-2-diazonio-1-ethoxyethen-1-olate,
I14-10009,
(Z)-2-(4-bromophenyl)-2-diazonio-1-ethoxy-ethenolate,
C10H9BrN2O2,
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| Complexity | 279 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 267.985g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 269.098g/mol |
| Monoisotopic Mass | 267.985g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 28.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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