| CAS Number | 27143-12-0 |
| Catalog Number | AG01DX8D(AGN-PC-0KKU82) |
| Chemical Name | Acetic acid, chloro[(2,4-dichlorophenyl)hydrazono]-, ethyl ester |
| EC Number | 608-054-2 |
| IUPAC Name | ethyl (2Z)-2-chloro-2-[(2,4-dichlorophenyl)hydrazinylidene]acetate |
| InChI | InChI=1S/C10H9Cl3N2O2/c1-2-17-10(16)9(13)15-14-8-4-3-6(11)5-7(8)12/h3-5,14H,2H2,1H3/b15-9- |
| InChI Key | MTWAKBYVMJYUSU-DHDCSXOGSA-N |
| MDL Number | MFCD00841920 |
| Molecular Formula | C10H9Cl3N2O2 |
| Molecular Weight | 295.5497 |
| SMILES | O=C(OCC)/C(Cl)=N/NC1=CC=C(Cl)C=C1Cl |
| Synonyms | 27143-12-0,
AC1NWMLE,
SCHEMBL10056749,
ZINC8383126,
ethyl chloro[2-(2,4-dichlorophenyl)hydrazinylidene]ethanoate,
Acetic acid, chloro[(2,4-dichlorophenyl)hydrazono]-, ethyl ester,
ethyl (2Z)-2-chloro-2-[(2,4-dichlorophenyl)hydrazinylidene]acetate,
ETHYL (2Z)-2-CHLORO-2-[2-(2,4-DICHLOROPHENYL)HYDRAZIN-1-YLIDENE]ACETATE,
ZINC08383126,
CID5708310,
ethyl (2E)-chloro[(2,4-dichlorophenyl)hydrazono]acetate,
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| Complexity | 299 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Exact Mass | 293.973g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 295.544g/mol |
| Monoisotopic Mass | 293.973g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 50.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.9 |
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Certificate of Analysis
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