| CAS Number | 86518-07-2 |
| Catalog Number | AG01BXW5(AGN-PC-0V670J) |
| Chemical Name | 4-Chlorofuro[3,2-c]pyridine-2-carboxaldehyde |
| IUPAC Name | 4-chlorofuro[3,2-c]pyridine-2-carbaldehyde |
| InChI | InChI=1S/C8H4ClNO2/c9-8-6-3-5(4-11)12-7(6)1-2-10-8/h1-4H |
| InChI Key | JUBUEOUKRFKRFP-UHFFFAOYSA-N |
| MDL Number | MFCD21338995 |
| Molecular Formula | C8H4ClNO2 |
| Molecular Weight | 181.5759 |
| NSC Number | 382283 |
| SMILES | ClC1=C2C(OC(=C2)C=O)=CC=N1 |
| Synonyms | 4-chlorofuro[3,2-c]pyridine-2-carbaldehyde,
86518-07-2,
NSC382283,
AC1L7XT5,
SCHEMBL18678557,
DTXSID50321833,
ZINC1591561,
AKOS015905646,
NSC-382283,
CS-0087991,
4-chloro-furo[4,5-c]pyridine-2-carbaldehyde,
I14-22291,
CID343182,
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| Complexity | 188 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 180.993g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 181.575g/mol |
| Monoisotopic Mass | 180.993g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
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Certificate of Analysis
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