Basic information
- CAS
27632-16-2- Standard SMILES
c1cc2c(s1)CCCC2NC1=NCCO1- InChIKey
AGFSEWXNGDAJGV-UHFFFAOYSA-N- Molecular formula
- C11H14N2OS
- Average molar mass
- 222.31 g/mol
- Monoisotopic mass
- 222.08268425
Names & identifiers
- Preferred name
- N-(4,5,6,7-Tetrahydro-1-benzothiophen-4-yl)-4,5-dihydro-1,3-oxazol-2-amine
- IUPAC
- N-(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)-4,5-dihydro-1,3-oxazol-2-amine
Names & synonyms
N-(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)-4,5-dihydro-1,3-oxazol-2-amine27632-16-2DTXSID40950292RefChem:1091190DTXCID8013784542-(4,5,6,7-Tetrahydro-benzothiophen-4-ylamino)-2-oxazolineSCHEMBL113322964,5,6,7-Tetrahydro-N-(2-oxazolin-2-yl)-4-benzo(b)thiophenamine4-BENZO(b)THIOPHENAMINE, 4,5,6,7-TETRAHYDRO-N-(2-OXAZOLIN-2-YL)-
Database identifiers
- CAS
27632-16-2- PubChem CID
- 33972
- DTXSID
DTXSID40950292- Nikkaji
- J67.783C
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 61.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 269
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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