(R)-5-Bromo-2,3-dihydro-1H-inden-2-ol - CAS 1246816-01-2
Catalog: |
BB072166 |
Product Name: |
(R)-5-Bromo-2,3-dihydro-1H-inden-2-ol |
CAS: |
1246816-01-2 |
Synonyms: |
(R)-5-Bromo-2,3-dihydro-1H-inden-2-ol; (2R)-5-BROMO-2,3-DIHYDRO-1H-INDEN-2-OL |
IUPAC Name: | (2R)-5-bromo-2,3-dihydro-1H-inden-2-ol |
Molecular Weight: | 213.07 |
Molecular Formula: | C9H9BrO |
Canonical SMILES: | C1C(CC2=C1C=CC(=C2)Br)O |
InChI: | InChI=1S/C9H9BrO/c10-8-2-1-6-4-9(11)5-7(6)3-8/h1-3,9,11H,4-5H2/t9-/m1/s1 |
InChI Key: | QYVONEHTDRTAHN-SECBINFHSA-N |
References: | Cannon, J., et al. J. Med. Chem., 25, 1442. |
Complexity: | 149 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 211.98368 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 211.98368 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 20.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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