8-Methoxythiochroman-3-amine
Basic information
- CAS
771454-16-1- Standard SMILES
COc1cccc2c1SCC(N)C2- InChIKey
GJHOYAFPOGJQBS-UHFFFAOYSA-N- Molecular formula
- C10H13NOS
- Average molar mass
- 195.28 g/mol
- Monoisotopic mass
- 195.07178521
Names & identifiers
- Preferred name
- 8-Methoxythiochroman-3-amine
- IUPAC
- 8-methoxy-3,4-dihydro-2H-thiochromen-3-amine
- English name
- 2H-1-Benzothiopyran-3-amine,3,4-dihydro-8-methoxy-(9CI)
- Molecular formula
- C10H13NOS
- Molecular weight
- 195.28
Names & synonyms
771454-16-18-METHOXYTHIOCHROMAN-3-AMINE8-METHOXY-THIOCHROMAN-3-YLAMINE8-methoxy-3,4-dihydro-2H-thiochromen-3-amine8-METHOXY-3,4-DIHYDRO-2H-1-BENZOTHIOPYRAN-3-AMINE2H-1-Benzothiopyran-3-amine,3,4-dihydro-8-methoxy-(9CI)8-Methoxy-3-thiochromanamine8-METHOXY-THIOCHROMAN-3-YLAMINE, 771454-16-1, AGN-PC-01MQ79, 8-METHOXYTHIOCHROMAN-3-AMINE, AKOS006294903, AB18496, KB-46863, FT-0692991, 8-methoxy-3,4-dihydro-2H-thiochromen-3-amine, 8-METHOXY-3,4-DIHYDRO-2H-1-BENZOTHIOPYRAN-3-AMINEDTXSID50591438AKOS006294903AB18496DB-229713
Show more names
2H-1-Benzothiopyran-3-amine, 3,4-dihydro-8-methoxy-
Database identifiers
- CAS
771454-16-1- PubChem CID
- 17877974
- DTXSID
DTXSID50591438
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 60.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 176
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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