(3-Bromophenyl)(4-fluorophenyl)methanol - CAS 247089-76-5
Catalog: |
BB071301 |
Product Name: |
(3-Bromophenyl)(4-fluorophenyl)methanol |
CAS: |
247089-76-5 |
Synonyms: |
(3-Bromophenyl)(4-fluorophenyl)methanol; 3-Bromo-4'-fluorobenzhydrol; (3-bromophenyl)-(4-fluorophenyl)methanol |
IUPAC Name: | (3-bromophenyl)-(4-fluorophenyl)methanol |
Description: | (3-Bromophenyl)(4-fluorophenyl)methanol |
Molecular Weight: | 281.12 |
Molecular Formula: | C13H10BrFO |
Canonical SMILES: | C1=CC(=CC(=C1)Br)C(C2=CC=C(C=C2)F)O |
InChI: | InChI=1S/C13H10BrFO/c14-11-3-1-2-10(8-11)13(16)9-4-6-12(15)7-5-9/h1-8,13,16H |
InChI Key: | YBUFCLFBGOTIMD-UHFFFAOYSA-N |
Complexity: | 216 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 279.98991 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 279.98991 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 20.2Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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