| CAS Number | 13054-98-3 |
| Catalog Number | AG00IMGJ(AGN-PC-03HBL0) |
| Chemical Name | Dibenzofuran, dodecahydro- |
| IUPAC Name | 1,2,3,4,4a,5a,6,7,8,9,9a,9b-dodecahydrodibenzofuran |
| InChI | InChI=1S/C12H20O/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h9-12H,1-8H2 |
| InChI Key | XTDNMGZRUWMVLT-UHFFFAOYSA-N |
| MDL Number | MFCD30749260 |
| Molecular Formula | C12H20O |
| Molecular Weight | 180.2866 |
| SMILES | C1CCC2C(C1)C3CCCCC3O2 |
| Synonyms | Dodecahydrodibenzofuran,
13054-98-3,
dodecahydro-dibenzofuran,
Dibenzofuran, dodecahydro-,
dodecahydrodibenzo[b,d]furan,
SCHEMBL453389,
XTDNMGZRUWMVLT-UHFFFAOYSA-N,
Dodecahydrodibenzofuran (mixture of isomers),
D5232,
|
| Complexity | 170 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 180.151g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 180.291g/mol |
| Monoisotopic Mass | 180.151g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 4 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number