| CAS Number | 1341039-23-3 |
| Catalog Number | AG00HT7N(AGN-PC-0WG3W8) |
| Chemical Name | 6,6-Difluoro-[1,4]Oxazepane Hydrochloride |
| IUPAC Name | 6,6-difluoro-1,4-oxazepane;hydrochloride |
| InChI | InChI=1S/C5H9F2NO.ClH/c6-5(7)3-8-1-2-9-4-5;/h8H,1-4H2;1H |
| InChI Key | MMOODUDIFAVCIO-UHFFFAOYSA-N |
| MDL Number | MFCD21362353 |
| Molecular Formula | C5H10ClF2NO |
| Molecular Weight | 173.5888 |
| SMILES | C1COCC(CN1)(F)F.Cl |
| Synonyms | 1341039-23-3,
6,6-Difluoro-[1,4]oxazepane HCl,
6,6-Difluoro-1,4-oxazepane hydrochloride,
6,6-DIFLUORO-[1,4]OXAZEPANE HYDROCHLORIDE,
6,6-difluoro-1,4-oxazepane;hydrochloride,
SCHEMBL17837260,
MMOODUDIFAVCIO-UHFFFAOYSA-N,
MFCD21362353,
AKOS027255502,
AM806227,
AS-39782,
CS-0036323,
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| Complexity | 97 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 173.042g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 173.588g/mol |
| Monoisotopic Mass | 173.042g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number