2-Isopropylphenylboronic Acid - CAS 89787-12-2
Catalog: |
BB039595 |
Product Name: |
2-Isopropylphenylboronic Acid |
CAS: |
89787-12-2 |
Synonyms: |
(2-propan-2-ylphenyl)boronic acid; (2-propan-2-ylphenyl)boronic acid |
IUPAC Name: | (2-propan-2-ylphenyl)boronic acid |
Description: | 2-Isopropylphenylboronic Acid (CAS# 89787-12-2) is a useful research chemical. |
Molecular Weight: | 164.01 |
Molecular Formula: | C9H13O2B |
Canonical SMILES: | B(C1=CC=CC=C1C(C)C)(O)O |
InChI: | InChI=1S/C9H13BO2/c1-7(2)8-5-3-4-6-9(8)10(11)12/h3-7,11-12H,1-2H3 |
InChI Key: | KTZUVUWIBZMHMC-UHFFFAOYSA-N |
Boiling Point: | 297.2 °C at 760 mmHg |
Density: | 1.04 g/cm3 |
MDL: | MFCD03411937 |
LogP: | 0.48980 |
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 |
Publication Number | Title | Priority Date |
CN-112409241-A | Organic compound, application thereof and organic electroluminescent device adopting organic compound | 20201127 |
WO-2021208963-A1 | Bcl-2 inhibitor | 20200415 |
WO-2021154966-A1 | Compounds and compositions for use in treating skin disorders | 20200129 |
CN-111171721-A | Ceramizable ablation-resistant coating and preparation method thereof | 20200122 |
CN-111171721-B | Ceramizable ablation-resistant coating and preparation method thereof | 20200122 |
Complexity: | 137 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 164.1008598 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 164.1008598 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 40.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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