| CAS Number | 1211539-82-0 |
| Catalog Number | AG009J7C(AGN-PC-0WG3ZZ) |
| Chemical Name | 2,2-Difluoro-1,3-benzodioxol-5-ol |
| IUPAC Name | 2,2-difluoro-1,3-benzodioxol-5-ol |
| InChI | InChI=1S/C7H4F2O3/c8-7(9)11-5-2-1-4(10)3-6(5)12-7/h1-3,10H |
| InChI Key | GEHVTOIGEVNIEQ-UHFFFAOYSA-N |
| MDL Number | MFCD22414499 |
| Molecular Formula | C7H4F2O3 |
| Molecular Weight | 174.1017 |
| SMILES | OC1=CC=C(OC(F)(F)O2)C2=C1 |
| Synonyms | 2,2-difluorobenzo[d][1,3]dioxol-5-ol,
1211539-82-0,
2,2-difluoro-1,3-benzodioxol-5-ol,
2,2-difluoro-2H-1,3-benzodioxol-5-ol,
2,2-Difluorobenzodioxol-5-ol,
SCHEMBL2303611,
GEHVTOIGEVNIEQ-UHFFFAOYSA-N,
MFCD22414499,
ZINC118594176,
AK207347,
DS-10140,
A1-12970,
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| Complexity | 186 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 174.013g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 174.103g/mol |
| Monoisotopic Mass | 174.013g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 38.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number