| CAS Number | 84324-66-3 |
| Catalog Number | AG019UWN(AGN-PC-0NFTH8) |
| Chemical Name | 2,4-difluoro-N-[(pyridin-3-yl)methyl]aniline |
| IUPAC Name | 2,4-difluoro-N-(pyridin-3-ylmethyl)aniline |
| InChI | InChI=1S/C12H10F2N2/c13-10-3-4-12(11(14)6-10)16-8-9-2-1-5-15-7-9/h1-7,16H,8H2 |
| InChI Key | LDRSQLVXBAGLIR-UHFFFAOYSA-N |
| MDL Number | MFCD11145813 |
| Molecular Formula | C12H10F2N2 |
| Molecular Weight | 220.2180 |
| SMILES | FC1=CC(F)=C(NCC2=CN=CC=C2)C=C1 |
| Synonyms | 2,4-difluoro-N-(pyridin-3-ylmethyl)aniline,
84324-66-3,
AC1Q4LQZ,
SCHEMBL8773039,
CTK7B9167,
LDRSQLVXBAGLIR-UHFFFAOYSA-N,
ZINC19951810,
AKOS000238837,
MCULE-6739485606,
NE22404,
3-(2,4-difluorophenylaminomethyl)pyridine,
EN300-43056,
2,4-difluoro-N-[(pyridin-3-yl)methyl]aniline,
AB00999669-01,
N-(2,4-Difluorophenyl)-N-(3-pyridylmethyl)amine,
Z286529960,
CID11096129,
|
| Complexity | 213 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 220.081g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.223g/mol |
| Monoisotopic Mass | 220.081g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 24.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
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Certificate of Analysis
Lot Number