| CAS Number | 867205-19-4 |
| Catalog Number | AG00GUSQ(AGN-PC-0WNN6D) |
| Chemical Name | 2-Fluoro-6-(pyrrolidin-1-yl)benzaldehyde |
| IUPAC Name | 2-fluoro-6-pyrrolidin-1-ylbenzaldehyde |
| InChI | InChI=1S/C11H12FNO/c12-10-4-3-5-11(9(10)8-14)13-6-1-2-7-13/h3-5,8H,1-2,6-7H2 |
| InChI Key | GCJAQWVHRQAPGF-UHFFFAOYSA-N |
| MDL Number | MFCD06660487 |
| Molecular Formula | C11H12FNO |
| Molecular Weight | 193.2175 |
| SMILES | FC1=C(C=O)C(N2CCCC2)=CC=C1 |
| Synonyms | 2-fluoro-6-(pyrrolidin-1-yl)benzaldehyde,
867205-19-4,
2-fluoro-6-pyrrolidin-1-ylbenzaldehyde,
6-fluoro-2-(pyrrolidin-1-yl)benzaldehyde,
AC1MXWF7,
AC1Q4L3P,
MLS000807161,
CHEMBL1884957,
CTK7H8147,
HMS2670A23,
ZINC3886927,
MFCD06660487,
AKOS000117037,
MCULE-9461000078,
NE21772,
SMR000376278,
EN300-07353,
ZINC03886927,
CID3822448,
|
| Complexity | 204 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.221g/mol |
| Monoisotopic Mass | 193.09g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 20.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number