(3-Cyclohexylpropyl)boronic acid - CAS 1498314-72-9
Catalog: |
BB068855 |
Product Name: |
(3-Cyclohexylpropyl)boronic acid |
CAS: |
1498314-72-9 |
Synonyms: |
(3-CYCLOHEXYLPROPYL)BORONIC ACID; 3-cyclohexylpropylboronic acid; (3-CYCLOHEXYLPROPYL)BORONICACID |
IUPAC Name: | 3-cyclohexylpropylboronic acid |
Description: | (3-Cyclohexylpropyl)boronic acid |
Molecular Weight: | 170.06 |
Molecular Formula: | C9H19BO2 |
Canonical SMILES: | B(CCCC1CCCCC1)(O)O |
InChI: | InChI=1S/C9H19BO2/c11-10(12)8-4-7-9-5-2-1-3-6-9/h9,11-12H,1-8H2 |
InChI Key: | GTBWNHHUOFZPCS-UHFFFAOYSA-N |
Complexity: | 111 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 170.14781 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 170.14781 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 40.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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