3-Bromo-5-iodophenol - CAS 570391-20-7
Catalog: |
BB061917 |
Product Name: |
3-Bromo-5-iodophenol |
CAS: |
570391-20-7 |
Synonyms: |
3-BROMO-5-IODOPHENOL; 3-Bromo-5-iodo-phenol; Phenol, 3-bromo-5-iodo- |
IUPAC Name: | 3-bromo-5-iodophenol |
Molecular Weight: | 298.9 |
Molecular Formula: | C6H4BrIO |
Canonical SMILES: | C1=C(C=C(C=C1Br)I)O |
InChI: | InChI=1S/C6H4BrIO/c7-4-1-5(8)3-6(9)2-4/h1-3,9H |
InChI Key: | IQYQJLWQIUGDTI-UHFFFAOYSA-N |
Complexity: | 99.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 297.84902 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 297.84902 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 20.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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