| CAS Number | 24821-54-3 |
| Catalog Number | AG00C4A7(AGN-PC-0LA564) |
| Chemical Name | 4-Methoxy-1-methylnaphthalene |
| IUPAC Name | 1-methoxy-4-methylnaphthalene |
| InChI | InChI=1S/C12H12O/c1-9-7-8-12(13-2)11-6-4-3-5-10(9)11/h3-8H,1-2H3 |
| InChI Key | DUXRFNPXLWUXMT-UHFFFAOYSA-N |
| MDL Number | MFCD00021472 |
| Molecular Formula | C12H12O |
| Molecular Weight | 172.2231 |
| SMILES | COc1ccc(c2c1cccc2)C |
| Synonyms | 1-methoxy-4-methylnaphthalene,
4-Methoxy-1-methylnaphthalene,
24821-54-3,
1-methoxy-4-methyl-naphthalene,
DUXRFNPXLWUXMT-UHFFFAOYSA-N,
4-Methyl-1-methoxynaphthalene,
SCHEMBL637626,
AC1N985Y,
DTXSID70402658,
ZINC2163972,
MFCD00021472,
methyl 4-methylnaphthalen-1-yl ether,
AKOS024324100,
MCULE-2547013888,
DB-083627,
FT-0711528,
M2930,
InChI=1/C12H12O/c1-9-7-8-12(13-2)11-6-4-3-5-10(9)11/h3-8H,1-2H,
4-methoxy-1-methyl-naphthalene,
CID4381467,
|
| Complexity | 167 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 172.089g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 172.227g/mol |
| Monoisotopic Mass | 172.089g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number