| CAS Number | 1249528-13-9 |
| Catalog Number | AG00HHUS(AGN-PC-0WNOQ8) |
| Chemical Name | 1-N-Butyl-5,6-difluorobenzene-1,2-diamine |
| IUPAC Name | 2-N-butyl-3,4-difluorobenzene-1,2-diamine |
| InChI | InChI=1S/C10H14F2N2/c1-2-3-6-14-10-8(13)5-4-7(11)9(10)12/h4-5,14H,2-3,6,13H2,1H3 |
| InChI Key | INIYEAMWMXGPMD-UHFFFAOYSA-N |
| MDL Number | MFCD16787174 |
| Molecular Formula | C10H14F2N2 |
| Molecular Weight | 200.2284 |
| SMILES | CCCCNc1c(N)ccc(c1F)F |
| Synonyms | 1-N-Butyl-5,6-difluorobenzene-1,2-diamine,
1249528-13-9,
MFCD16787174,
ZINC53163487,
AKOS011823195,
N1-butyl-5,6-difluorobenzene-1,2-diamine,
|
| Complexity | 166 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 200.113g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 200.233g/mol |
| Monoisotopic Mass | 200.113g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 38A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number