trans-2-Phenylcyclobutane-1-carboxylic Acid - CAS 107841-64-5
Catalog: |
BB057445 |
Product Name: |
trans-2-Phenylcyclobutane-1-carboxylic Acid |
CAS: |
107841-64-5 |
Synonyms: |
trans-2-phenylcyclobutane-1-carboxylic acid; (1R,2R)-2-phenylcyclobutane-1-carboxylic acid; (1R,2R)-2-Phenylcyclobutanecarboxylic acid |
IUPAC Name: | (1R,2R)-2-phenylcyclobutane-1-carboxylic acid |
Description: | trans-2-Phenylcyclobutane-1-carboxylic acid (cas# 107841-64-5) is a useful research chemical for organic synthesis and other chemical processes. |
Molecular Weight: | 176.21 |
Molecular Formula: | C11H12O2 |
Canonical SMILES: | C1CC(C1C2=CC=CC=C2)C(=O)O |
InChI: | InChI=1S/C11H12O2/c12-11(13)10-7-6-9(10)8-4-2-1-3-5-8/h1-5,9-10H,6-7H2,(H,12,13)/t9-,10+/m0/s1 |
InChI Key: | NYTUABLWSVGNGV-VHSXEESVSA-N |
References: | Beard, C., et al. J. Org. Chem., 27, 1647 (1962); Hill, E., et al. J. Organomet. Chem., 302, 5 (1986). |
Complexity: | 194 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 176.083729621 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 176.083729621 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 37.3Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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