(Z)-1-(1,1-Dimethyl-2-heptenyl)-3-(benzyloxy)benzene - CAS 70120-10-4
Catalog: |
BB067026 |
Product Name: |
(Z)-1-(1,1-Dimethyl-2-heptenyl)-3-(benzyloxy)benzene |
CAS: |
70120-10-4 |
Synonyms: |
(Z)-1-(1,1-Dimethyl-2-heptenyl)-3-(phenylmethoxy)benzene |
IUPAC Name: | 1-[(Z)-2-methyloct-3-en-2-yl]-3-phenylmethoxybenzene |
Description: | Intermediate in the synthesis of 3-[2-Hydroxy-4-(substituted) phenyl]azacycloalkanes as analgesic agents. |
Molecular Weight: | 308.46 |
Molecular Formula: | C22H28O |
Canonical SMILES: | CCCCC=CC(C)(C)C1=CC(=CC=C1)OCC2=CC=CC=C2 |
InChI: | InChI=1S/C22H28O/c1-4-5-6-10-16-22(2,3)20-14-11-15-21(17-20)23-18-19-12-8-7-9-13-19/h7-17H,4-6,18H2,1-3H3/b16-10- |
InChI Key: | YCHVOSRRMUALAL-YBEGLDIGSA-N |
Solubility: | Chloroform, Dichloromethane, Ethyl Acetate, Methanol |
Appearance: | Colorless Oil |
Complexity: | 338 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 308.214015512 |
Formal Charge: | 0 |
Heavy Atom Count: | 23 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 308.214015512 |
Rotatable Bond Count: | 8 |
Topological Polar Surface Area: | 9.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 7.1 |
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