| CAS Number | 1204333-50-5 |
| Catalog Number | AG01DJ4T |
| Chemical Name | tert-Butyl (2,2-difluoroethyl)carbamate |
| IUPAC Name | tert-butyl N-(2,2-difluoroethyl)carbamate |
| InChI | InChI=1S/C7H13F2NO2/c1-7(2,3)12-6(11)10-4-5(8)9/h5H,4H2,1-3H3,(H,10,11) |
| InChI Key | VQTOBQFJNNYMPX-UHFFFAOYSA-N |
| MDL Number | MFCD23728215 |
| Molecular Formula | C7H13F2NO2 |
| Molecular Weight | 181.1804 |
| SMILES | CC(C)(C)OC(=O)NCC(F)F |
| Synonyms | tert-butyl N-(2,2-difluoroethyl)carbamate,
1204333-50-5,
SCHEMBL10035060,
VQTOBQFJNNYMPX-UHFFFAOYSA-N,
tert-butyl 2,2-difluoroethylcarbamate,
AKOS017640750,
tert-Butyl (2,2-difluoroethyl)carbamate,
AS-64272,
CS-0080201,
|
| Complexity | 154 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 181.091435g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 181.18g/mol |
| Monoisotopic Mass | 181.091435g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 38.3Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number