compound introduction
5-甲氧基吲哚是吲哚类化合物的一种。
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5-methoxy-1H-indole
CAS number：1006-94-6 molecular formula：C9H9NO
overview
Specs
| Chinese alias | - | ||
| English alias | - | ||
| CAS number | 1006-94-6 | molecular formula | C9H9NO |
| molecular weight | 147.17 | Exact mass | - |
| PSA | 25 | logp | 2.1 |
numbering system
| CAS | 1006-94-6 |
| UNII | DQM3AS43PQ |
| HMDB ID | HMDB0246822 |
| ChEBI ID | 167807 |
| Wikidata | Q27276543 |
| ChEMBL ID | CHEMBL280311 |
| NSC Number | NSC Number: NSC521752 |
| PubChem CID | 13872 |
| Nikkaji Number | J12.258K |
| DSSTox Substance ID | DTXSID80143424 |
| European Community (EC) Number | 213-745-3 |
| PubChem Reference Collection SID | 500746480 |
| MEP ID | _25Q1B3UEI |
physicochemical properties
| XLogP3 | 2.1 |
| Complexity | 138 |
| Exact Mass | 147.068413911 |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Molecular Weight | 147.17 |
| Monoisotopic Mass | 147.068413911 |
| Isotope Atom Count | 0 |
| Rotatable Bond Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Covalently-Bonded Unit Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Topological Polar Surface Area | 25 Ų |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
Safety information
Hazard Classes and Categories：
STOT SE 3 (94.2%)
Production methods and uses
No production method and use information yet
Related
upstream information
No upstream information yet
downstream information
No downstream information yet
MSDS
Found 1 shareMSDS
1006-94-6 | 5-Methoxyindole.pdf
