| CAS Number | 1627844-78-3 |
| Catalog Number | AG00IMD4(AGN-PC-0WQUR9) |
| Chemical Name | 4,4'-Bis(decyloxy)-3-methylazobenzene |
| IUPAC Name | (4-decoxy-3-methylphenyl)-(4-decoxyphenyl)diazene |
| InChI | InChI=1S/C33H52N2O2/c1-4-6-8-10-12-14-16-18-26-36-32-23-20-30(21-24-32)34-35-31-22-25-33(29(3)28-31)37-27-19-17-15-13-11-9-7-5-2/h20-25,28H,4-19,26-27H2,1-3H3 |
| InChI Key | HBJQHHIKMMWGLL-UHFFFAOYSA-N |
| MDL Number | MFCD30742892 |
| Molecular Formula | C33H52N2O2 |
| Molecular Weight | 508.7782 |
| SMILES | CCCCCCCCCCOC1=CC=C(C=C1)N=NC2=CC(=C(C=C2)OCCCCCCCCCC)C |
| Synonyms | 4,4'-Bis(decyloxy)-3-methylazobenzene,
1627844-78-3,
B4597,
J3.661.049B,
J3.661.051D,
2-Methyl-[(E)-4,4'-azobis(1-(decyloxy)benzene)],
2-Methyl-[(Z)-4,4'-azobis(1-(decyloxy)benzene)],
|
| Complexity | 532 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 508.403g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 37 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 508.791g/mol |
| Monoisotopic Mass | 508.403g/mol |
| Rotatable Bond Count | 22 |
| Topological Polar Surface Area | 43.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 13 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number