3-Fluoro-5-methoxyphenylboronic acid - CAS 609807-25-2
Catalog: |
BB030885 |
Product Name: |
3-Fluoro-5-methoxyphenylboronic acid |
CAS: |
609807-25-2 |
Synonyms: |
(3-fluoro-5-methoxyphenyl)boronic acid; (3-fluoro-5-methoxyphenyl)boronic acid |
IUPAC Name: | (3-fluoro-5-methoxyphenyl)boronic acid |
Description: | 3-Fluoro-5-methoxyphenylboronic acid (CAS# 609807-25-2) is a useful research chemical. |
Molecular Weight: | 169.95 |
Molecular Formula: | C7H8BFO3 |
Canonical SMILES: | B(C1=CC(=CC(=C1)F)OC)(O)O |
InChI: | InChI=1S/C7H8BFO3/c1-12-7-3-5(8(10)11)2-6(9)4-7/h2-4,10-11H,1H3 |
InChI Key: | MQFKLCWETPKBCH-UHFFFAOYSA-N |
Boiling Point: | 305.5 °C at 760 mmHg |
Flash Point: | Not applicable |
Purity: | 98 % |
Density: | 1.26 g/cm3 |
MDL: | MFCD07363780 |
LogP: | -0.48590 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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Complexity: | 145 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 170.0550524 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 170.0550524 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 49.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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