| CAS Number | 124369-60-4 |
| Catalog Number | AG019ESY |
| Chemical Name | 5-Bromo-3,3-dimethyl-2,3-dihydro-1H-inden-1-ol |
| IUPAC Name | 5-bromo-3,3-dimethyl-1,2-dihydroinden-1-ol |
| InChI | InChI=1S/C11H13BrO/c1-11(2)6-10(13)8-4-3-7(12)5-9(8)11/h3-5,10,13H,6H2,1-2H3 |
| InChI Key | XVAFCINZVXDETG-UHFFFAOYSA-N |
| MDL Number | MFCD27942516 |
| Molecular Formula | C11H13BrO |
| Molecular Weight | 241.1243 |
| SMILES | CC1(C)CC(O)c2ccc(Br)cc12 |
| Synonyms | 5-Bromo-3,3-dimethyl-2,3-dihydro-1H-inden-1-ol,
124369-60-4,
1H-Inden-1-ol, 5-bromo-2,3-dihydro-3,3-dimethyl-,
SCHEMBL6493913,
MFCD27942516,
CS-0060073,
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| Complexity | 202 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 240.015g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.128g/mol |
| Monoisotopic Mass | 240.015g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
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Certificate of Analysis
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