| CAS Number | 325720-96-5 |
| Catalog Number | AG00I663(AGN-PC-0WR4FD) |
| Chemical Name | 2-{[3-(trifluoromethyl)phenyl]amino}acetohydrazide |
| IUPAC Name | 2-[3-(trifluoromethyl)anilino]acetohydrazide |
| InChI | InChI=1S/C9H10F3N3O/c10-9(11,12)6-2-1-3-7(4-6)14-5-8(16)15-13/h1-4,14H,5,13H2,(H,15,16) |
| InChI Key | BOGMWLKAYHXRGR-UHFFFAOYSA-N |
| MDL Number | MFCD03110639 |
| Molecular Formula | C9H10F3N3O |
| Molecular Weight | 233.1904 |
| SMILES | NNC(CNC1=CC(C(F)(F)F)=CC=C1)=O |
| Synonyms | (3-Trifluoromethyl-phenylamino)-acetic acid hydrazide,
2-{[3-(trifluoromethyl)phenyl]amino}acetohydrazide,
MCULE-5557771559,
NE61484,
BAS 02070025,
2-[3-(trifluoromethyl)anilino]acetohydrazide,
BB 0241508,
(3-Trifluoromethyl-phenylamino)-acetic acid hydrazide,
CID788637,
ZINC00287784,
325720-96-5,
EN300-03693,
AC1LG4AO,
AC1Q54YQ,
CTK7F1159,
ZINC287784,
MFCD03110639,
AKOS000116112,
|
| Complexity | 245 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 233.078g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 233.194g/mol |
| Monoisotopic Mass | 233.078g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 67.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number