4- Chloro- 1- naphthylboronic Acid - CAS 147102-97-4
Catalog: |
BB055644 |
Product Name: |
4- Chloro- 1- naphthylboronic Acid |
CAS: |
147102-97-4 |
Synonyms: |
B-(4-Chloro-1-naphthalenyl)boronic Acid;(4-Chloronaphthalen-1-yl)boronic Acid |
IUPAC Name: | (4-chloronaphthalen-1-yl)boronic acid |
Description: | 4- Chloro- 1- naphthylboronic Acid is a reagent used in the preparation of electroluminescent devices. |
Molecular Weight: | 206.43 |
Molecular Formula: | C10H8BClO2 |
Canonical SMILES: | B(C1=CC=C(C2=CC=CC=C12)Cl)(O)O |
InChI: | InChI=1S/C10H8BClO2/c12-10-6-5-9(11(13)14)7-3-1-2-4-8(7)10/h1-6,13-14H |
InChI Key: | PIHWNQAUHGAUGC-UHFFFAOYSA-N |
References: | Stoessel, P. et. al. PCT Int. Appl. (2018), WO 2018041769 A1 20180308. |
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 |
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Complexity: | 201 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 206.0305874 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 206.0305874 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 40.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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