| CAS Number | 67272-07-5 |
| Catalog Number | AG005PLX(AGN-PC-0H0YM5) |
| Chemical Name | 2-(Difluoromethyl)aniline |
| IUPAC Name | 2-(difluoromethyl)aniline |
| InChI | InChI=1S/C7H7F2N/c8-7(9)5-3-1-2-4-6(5)10/h1-4,7H,10H2 |
| InChI Key | VZMLDJWNYZQBHA-UHFFFAOYSA-N |
| MDL Number | MFCD18791596 |
| Molecular Formula | C7H7F2N |
| Molecular Weight | 143.1340 |
| SMILES | NC1=CC=CC=C1C(F)F |
| Synonyms | 2-(Difluoromethyl)aniline,
67272-07-5,
SCHEMBL2020473,
CTK8B6411,
DTXSID40735263,
ANW-53415,
FCH995726,
MFCD18791596,
ZINC77032059,
AKOS015999450,
AK-93353,
AS-39742,
AJ-122561,
AX8230872,
TC-142160,
ST24021871,
EN300-170416,
|
| Complexity | 106 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 143.055g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 143.137g/mol |
| Monoisotopic Mass | 143.055g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
|
|
Hazard statements
|
H302-H315-H319-H335
|
|
Packing Group
|
|
|
Precautionary statements
|
P261-P305+P351+P338
|
|
UN Code
|
|
Certificate of Analysis
Lot Number