| CAS Number | 66869-77-0 |
| Catalog Number | AG00FH3P(AGN-PC-0WD05L) |
| Chemical Name | Ethyl 3-chlorothieno[2,3-b]pyridine-2-carboxylate |
| IUPAC Name | ethyl 3-chlorothieno[2,3-b]pyridine-2-carboxylate |
| InChI | InChI=1S/C10H8ClNO2S/c1-2-14-10(13)8-7(11)6-4-3-5-12-9(6)15-8/h3-5H,2H2,1H3 |
| InChI Key | JCVFKGMSIUJSRU-UHFFFAOYSA-N |
| MDL Number | MFCD08695791 |
| Molecular Formula | C10H8ClNO2S |
| Molecular Weight | 241.6940 |
| SMILES | CCOC(=O)C1=C(Cl)C2=CC=CN=C2S1 |
| Synonyms | Ethyl 3-chlorothieno[2,3-b]pyridine-2-carboxylate,
66869-77-0,
KS-00000P3I,
MFCD08695791,
ZINC39296325,
AKOS000281874,
AJ-99699,
AK-51417,
DS-15829,
4CH-002245,
ST24046949,
3-chloro-thieno[2,3-b]pyridine-2-carboxylic acid ethyl ester,
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| Complexity | 252 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 240.996g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.689g/mol |
| Monoisotopic Mass | 240.996g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 67.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number