| CAS Number | 1033227-40-5 |
| Catalog Number | AG01A53D |
| Chemical Name | N1-(2,4-difluorophenyl)benzene-1,2-diamine |
| IUPAC Name | 2-N-(2,4-difluorophenyl)benzene-1,2-diamine |
| InChI | InChI=1S/C12H10F2N2/c13-8-5-6-11(9(14)7-8)16-12-4-2-1-3-10(12)15/h1-7,16H,15H2 |
| InChI Key | BGBSSHMFWJXZOZ-UHFFFAOYSA-N |
| MDL Number | MFCD11201984 |
| Molecular Formula | C12H10F2N2 |
| Molecular Weight | 220.2180 |
| SMILES | NC1=C(NC2=C(F)C=C(F)C=C2)C=CC=C1 |
| Synonyms | 1-N-(2,4-difluorophenyl)benzene-1,2-diamine,
1033227-40-5,
N1-(2,4-difluorophenyl)benzene-1,2-diamine,
SCHEMBL3606443,
BGBSSHMFWJXZOZ-UHFFFAOYSA-N,
ZINC20585605,
AKOS009280584,
MCULE-8290912138,
NE15115,
N-(2,4-difluorophenyl)benzene-1,2-diamine,
Z1623872247,
|
| Complexity | 225 |
| 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 | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.223g/mol |
| Monoisotopic Mass | 220.081g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 38A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
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Certificate of Analysis
Lot Number