rac-cis-[3-Benzoyloxycyclohexyl]benzamide - CAS 1346599-52-7
Catalog: |
BB073850 |
Product Name: |
rac-cis-[3-Benzoyloxycyclohexyl]benzamide |
CAS: |
1346599-52-7 |
Synonyms: |
rac-cis-[3-Benzoyloxycyclohexyl]benzamide; [(1R,3S)-3-benzamidocyclohexyl] benzoate |
IUPAC Name: | [(1R,3S)-3-benzamidocyclohexyl] benzoate |
Description: | rac-cis-[3-Benzoyloxycyclohexyl]benzamide (cas# 1346599-52-7) is a compound useful in organic synthesis. |
Molecular Weight: | 323.39 |
Molecular Formula: | C20H21NO3 |
Canonical SMILES: | C1CC(CC(C1)OC(=O)C2=CC=CC=C2)NC(=O)C3=CC=CC=C3 |
InChI: | InChI=1S/C20H21NO3/c22-19(15-8-3-1-4-9-15)21-17-12-7-13-18(14-17)24-20(23)16-10-5-2-6-11-16/h1-6,8-11,17-18H,7,12-14H2,(H,21,22)/t17-,18+/m0/s1 |
InChI Key: | IADWFZWQXGGJQZ-ZWKOTPCHSA-N |
Solubility: | Dimethyl Sulfoxide, Methanol |
Appearance: | White Solid |
Complexity: | 425 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 323.15214353 |
Formal Charge: | 0 |
Heavy Atom Count: | 24 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 323.15214353 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 55.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.1 |
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