| CAS Number | 128140-72-7 |
| Catalog Number | AG00HRRK(AGN-PC-02DBTM) |
| Chemical Name | 4-(2,2-Difluoroethoxy)Benzaldehyde |
| IUPAC Name | 4-(2,2-difluoroethoxy)benzaldehyde |
| InChI | InChI=1S/C9H8F2O2/c10-9(11)6-13-8-3-1-7(5-12)2-4-8/h1-5,9H,6H2 |
| InChI Key | MFNUWGXZNWXFAA-UHFFFAOYSA-N |
| MDL Number | MFCD12807547 |
| Molecular Formula | C9H8F2O2 |
| Molecular Weight | 186.1554 |
| SMILES | O=Cc1ccc(cc1)OCC(F)F |
| Synonyms | 4-(2,2-difluoroethoxy)benzaldehyde,
128140-72-7,
Benzaldehyde, 4-(2,2-difluoroethoxy)-,
SCHEMBL832671,
MFNUWGXZNWXFAA-UHFFFAOYSA-N,
MFCD12807547,
SBB073425,
STL414881,
ZINC37756010,
AKOS005169282,
MCULE-4531489348,
NE27095,
AM803135,
CS-0036312,
ST45256015,
EN300-90370,
C9H8F2O2,
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| Complexity | 154 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 186.049g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 186.158g/mol |
| Monoisotopic Mass | 186.049g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number