(2-Bromo-4-methylphenyl)methanol - CAS 824-53-3
Catalog: |
BB072501 |
Product Name: |
(2-Bromo-4-methylphenyl)methanol |
CAS: |
824-53-3 |
Synonyms: |
(2-Bromo-4-methylphenyl)methanol; 2-Bromo-4-methylbenzyl alcohol; Benzenemethanol, 2-bromo-4-methyl- |
IUPAC Name: | (2-bromo-4-methylphenyl)methanol |
Description: | (2-Bromo-4-methylphenyl)methanol is used in preparation of 6,7-Dihydro-5H-diphenyl[a,c]cyclohepten-5-one compounds. |
Molecular Weight: | 201.06 |
Molecular Formula: | C8H9OBr |
Canonical SMILES: | CC1=CC(=C(C=C1)CO)Br |
InChI: | InChI=1S/C8H9BrO/c1-6-2-3-7(5-10)8(9)4-6/h2-4,10H,5H2,1H3 |
InChI Key: | RAJNCYHWPIQECA-UHFFFAOYSA-N |
Complexity: | 105 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 199.98368 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 199.98368 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 20.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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