| CAS Number | 648904-47-6 |
| Catalog Number | AG00ELAA(AGN-PC-00EG2X) |
| Chemical Name | 2-(Benzyloxy)-1-bromo-6-methoxynaphthalene |
| IUPAC Name | 1-bromo-6-methoxy-2-phenylmethoxynaphthalene |
| InChI | InChI=1S/C18H15BrO2/c1-20-15-8-9-16-14(11-15)7-10-17(18(16)19)21-12-13-5-3-2-4-6-13/h2-11H,12H2,1H3 |
| InChI Key | QRONLZOWBNLXQD-UHFFFAOYSA-N |
| MDL Number | MFCD09027317 |
| Molecular Formula | C18H15BrO2 |
| Molecular Weight | 343.2145 |
| SMILES | C(C1=CC=CC=C1)OC1=C(C2=CC=C(C=C2C=C1)OC)Br |
| Synonyms | 2-(Benzyloxy)-1-bromo-6-methoxynaphthalene,
648904-47-6,
2-Benzyloxy-1-bromo-6-methoxynaphthalene,
2-benzyloxy-1-bromo-6-methoxy-naphthalene,
SCHEMBL1359254,
CTK2A1895,
DTXSID90470879,
QRONLZOWBNLXQD-UHFFFAOYSA-N,
MFCD09027317,
ZINC38278623,
AKOS030527666,
CS-W004467,
1-Bromo-2-(benzyloxy)-6-methoxynaphthalene,
J3.576.735E,
Naphthalene, 1-bromo-6-methoxy-2-(phenylmethoxy)-,
CID11702908,
1-bromo-6-methoxy-2-phenylmethoxy-naphthalene,
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| Complexity | 316 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 342.026g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 343.22g/mol |
| Monoisotopic Mass | 342.026g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 5.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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