| CAS Number | 754920-30-4 |
| Catalog Number | AG01AC59 |
| Chemical Name | [4-(Difluoromethyl)Phenyl]Methanamine |
| IUPAC Name | [4-(difluoromethyl)phenyl]methanamine |
| InChI | InChI=1S/C8H9F2N/c9-8(10)7-3-1-6(5-11)2-4-7/h1-4,8H,5,11H2 |
| InChI Key | MYVFDIOOJGKYKA-UHFFFAOYSA-N |
| MDL Number | MFCD18791602 |
| Molecular Formula | C8H9F2N |
| Molecular Weight | 157.1606 |
| SMILES | NCc1ccc(cc1)C(F)F |
| Synonyms | [4-(difluoromethyl)phenyl]methanamine,
754920-30-4,
(4-(difluoromethyl)phenyl)methanamine,
ZINC91305388,
AKOS016368417,
NE24002,
F2147-4590,
4-(Difluoromethyl)benzylamine,
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| Complexity | 109 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 157.07g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 157.164g/mol |
| Monoisotopic Mass | 157.07g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number