| CAS Number | 1346539-47-6 |
| Catalog Number | AG00HTF0 |
| Chemical Name | Methyl 1-(6-bromopyridin-3-YL)cyclopropanecarboxylate |
| IUPAC Name | methyl 1-(6-bromopyridin-3-yl)cyclopropane-1-carboxylate |
| InChI | InChI=1S/C10H10BrNO2/c1-14-9(13)10(4-5-10)7-2-3-8(11)12-6-7/h2-3,6H,4-5H2,1H3 |
| InChI Key | WNPDYEMTVKSUDK-UHFFFAOYSA-N |
| MDL Number | MFCD25542299 |
| Molecular Formula | C10H10BrNO2 |
| Molecular Weight | 256.0959 |
| SMILES | COC(=O)C1(CC1)C1=CN=C(Br)C=C1 |
| Synonyms | METHYL 1-(6-BROMOPYRIDIN-3-YL)CYCLOPROPANECARBOXYLATE,
1346539-47-6,
SCHEMBL12988979,
MFCD25542299,
ZINC95803887,
AS-41897,
|
| Complexity | 240 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 254.989g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 256.099g/mol |
| Monoisotopic Mass | 254.989g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 39.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
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Certificate of Analysis
Lot Number