2,3-Dichloro-4-methoxyphenylboronic acid - CAS 1190219-72-7
Catalog: |
BB067981 |
Product Name: |
2,3-Dichloro-4-methoxyphenylboronic acid |
CAS: |
1190219-72-7 |
Synonyms: |
(2,3-Dichloro-4-methoxyphenyl)boronic acid; 2,3-Dichloro-4-methoxyphenylboronic acid; (2,3-Dichloro-4-methoxyphenyl)boronicacid |
IUPAC Name: | (2,3-dichloro-4-methoxyphenyl)boronic acid |
Description: | 2,3-Dichloro-4-methoxyphenylboronic acid |
Molecular Weight: | 220.85 |
Molecular Formula: | C7H7BCl2O3 |
Canonical SMILES: | B(C1=C(C(=C(C=C1)OC)Cl)Cl)(O)O |
InChI: | InChI=1S/C7H7BCl2O3/c1-13-5-3-2-4(8(11)12)6(9)7(5)10/h2-3,11-12H,1H3 |
InChI Key: | FBELHXIPMFECAK-UHFFFAOYSA-N |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 170 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 219.9865296 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 219.9865296 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 49.7Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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