| CAS Number | 1257996-82-9 |
| Catalog Number | AG000ORH(AGN-PC-0H3A2F) |
| Chemical Name | 5,8-Dioxaspiro[3.4]octane, 2-bromo- |
| IUPAC Name | 2-bromo-5,8-dioxaspiro[3.4]octane |
| InChI | InChI=1S/C6H9BrO2/c7-5-3-6(4-5)8-1-2-9-6/h5H,1-4H2 |
| InChI Key | ROJASEXNUCZUED-UHFFFAOYSA-N |
| MDL Number | MFCD20637976 |
| Molecular Formula | C6H9BrO2 |
| Molecular Weight | 193.0385 |
| SMILES | BrC1CC2(OCCO2)C1 |
| Synonyms | 2-BROMO-5,8-DIOXASPIRO[3.4]OCTANE,
1257996-82-9,
SCHEMBL1358584,
ROJASEXNUCZUED-UHFFFAOYSA-N,
KS-000007QM,
MFCD20637976,
ZINC95742750,
AKOS025290751,
2-bromo-5,8-dioxa-spiro[3.4]octane,
PB33523,
5,8-Dioxaspiro[3.4]octane, 2-bromo-,
AS-34791,
CS-0052000,
Q-2404,
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| Complexity | 112 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.979g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.04g/mol |
| Monoisotopic Mass | 191.979g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
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Hazard Class
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Hazard statements
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H302
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Packing Group
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Precautionary statements
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P280-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number