5-BROMO-1,3-DIHYDROXYMETHYLBENZENE - CAS 51760-22-6
Catalog: |
BB043885 |
Product Name: |
5-BROMO-1,3-DIHYDROXYMETHYLBENZENE |
CAS: |
51760-22-6 |
Synonyms: |
(5-Bromo-1,3-phenylene)dimethanol; 5-Bromo-3-(hydroxymethyl)benzyl alcohol; (3-Bromo-5-hydroxymethyl-phenyl)-methanol |
IUPAC Name: | [3-bromo-5-(hydroxymethyl)phenyl]methanol |
Description: | 5-BROMO-1,3-DIHYDROXYMETHYLBENZENE (CAS# 51760-22-6 ) is a useful research chemical. |
Molecular Weight: | 217.06 |
Molecular Formula: | C8H9BrO2 |
Canonical SMILES: | C1=C(C=C(C=C1CO)Br)CO |
InChI: | InChI=1S/C8H9BrO2/c9-8-2-6(4-10)1-7(3-8)5-11/h1-3,10-11H,4-5H2 |
InChI Key: | IZWWAHXLUWAJRC-UHFFFAOYSA-N |
Purity: | 95 % |
Complexity: | 107 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 215.97859 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 215.97859 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 40.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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