2- Bromo- 3- fluoro- 5- methoxyphenol - CAS 1785528-41-7
Catalog: |
BB073386 |
Product Name: |
2- Bromo- 3- fluoro- 5- methoxyphenol |
CAS: |
1785528-41-7 |
Synonyms: |
2-bromo-3-fluoro-5-methoxyphenol; 4-Bromo-3-fluoro-5-hydroxyanisole |
IUPAC Name: | 2-bromo-3-fluoro-5-methoxyphenol |
Molecular Weight: | 221.02 |
Molecular Formula: | C7H6BrFO2 |
Canonical SMILES: | COC1=CC(=C(C(=C1)F)Br)O |
InChI: | InChI=1S/C7H6BrFO2/c1-11-4-2-5(9)7(8)6(10)3-4/h2-3,10H,1H3 |
InChI Key: | PCNLOJWCHPFNRI-UHFFFAOYSA-N |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 134 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 219.95352 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 219.95352 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 29.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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