1,13-Bisbenzyloxy-7-tridecanone - CAS 1217082-18-2
Catalog: |
BB073223 |
Product Name: |
1,13-Bisbenzyloxy-7-tridecanone |
CAS: |
1217082-18-2 |
Synonyms: |
1,13-Bis(phenylmethoxy)-7-tridecanone |
IUPAC Name: | 1,13-bis(phenylmethoxy)tridecan-7-one |
Description: | 1,13-Bisbenzyloxy-7-tridecanone (cas# 1217082-18-2) is a compound useful in organic synthesis. |
Molecular Weight: | 410.59 |
Molecular Formula: | C27H38O3 |
Canonical SMILES: | C1=CC=C(C=C1)COCCCCCCC(=O)CCCCCCOCC2=CC=CC=C2 |
InChI: | InChI=1S/C27H38O3/c28-27(19-11-1-3-13-21-29-23-25-15-7-5-8-16-25)20-12-2-4-14-22-30-24-26-17-9-6-10-18-26/h5-10,15-18H,1-4,11-14,19-24H2 |
InChI Key: | BJRWCOBRUFZJGO-UHFFFAOYSA-N |
Solubility: | Dichloromethane, Ethyl Acetate |
Appearance: | Colourless Oil |
Complexity: | 361 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 410.28209507 |
Formal Charge: | 0 |
Heavy Atom Count: | 30 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 410.28209507 |
Rotatable Bond Count: | 18 |
Topological Polar Surface Area: | 35.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 5.7 |
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