6-Bromo-2,3-dihydro-1H-indole-2-methanol - CAS 1391330-96-3
Catalog: |
BB072189 |
Product Name: |
6-Bromo-2,3-dihydro-1H-indole-2-methanol |
CAS: |
1391330-96-3 |
Synonyms: |
(6-Bromoindolin-2-yl)methanol |
IUPAC Name: | (6-bromo-2,3-dihydro-1H-indol-2-yl)methanol |
Molecular Weight: | 228.09 |
Molecular Formula: | C9H10BrNO |
Canonical SMILES: | C1C(NC2=C1C=CC(=C2)Br)CO |
InChI: | InChI=1S/C9H10BrNO/c10-7-2-1-6-3-8(5-12)11-9(6)4-7/h1-2,4,8,11-12H,3,5H2 |
InChI Key: | NSOIFXMCSOITKA-UHFFFAOYSA-N |
Complexity: | 165 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 226.99458 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 226.99458 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 32.3Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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