| CAS Number | 431046-37-6 |
| Catalog Number | AG00DXDU(AGN-PC-07AUUH) |
| Chemical Name | 5-Methoxy-1H-indol-4-amine |
| IUPAC Name | 5-methoxy-1H-indol-4-amine |
| InChI | InChI=1S/C9H10N2O/c1-12-8-3-2-7-6(9(8)10)4-5-11-7/h2-5,11H,10H2,1H3 |
| InChI Key | YTRLGXQPTYRYKK-UHFFFAOYSA-N |
| MDL Number | MFCD18808975 |
| Molecular Formula | C9H10N2O |
| Molecular Weight | 162.1885 |
| SMILES | NC1=C(OC)C=CC2=C1C=CN2 |
| Synonyms | 5-methoxy-1H-indol-4-amine,
431046-37-6,
SCHEMBL5704873,
1H-Indol-4-amine, 5-methoxy-,
ZINC45823782,
AKOS022906226,
MCULE-1743795840,
NE49435,
FT-0726867,
Z1820178775,
1H-Indol-4-amine,5-methoxy-,
1H-Indol-4-amine, 5-methoxy-,
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| Complexity | 163 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 162.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 162.192g/mol |
| Monoisotopic Mass | 162.079g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 51A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number