Basic information
- CAS
5977-99-1- Standard SMILES
SCCNc1ccccc1- InChIKey
GSZFZXVMYGIDGE-UHFFFAOYSA-N- Molecular formula
- C8H11NS
- Average molar mass
- 153.25 g/mol
- Monoisotopic mass
- 153.06122053
Names & identifiers
- Preferred name
- 2-Anilinoethanethiol
- IUPAC
- 2-anilinoethanethiol
- English name
- 2-anilinoethanethiol
- Molecular formula
- C8H11NS
- Molecular weight
- 0
Names & synonyms
5977-99-12-anilinoethanethiolN-PhenylcysteaminNSC68901SCHEMBL790635SCHEMBL1203153SCHEMBL4760595SCHEMBL16861366SCHEMBL16861416NSC-68901DB-292982
Database identifiers
- CAS
5977-99-1- PubChem CID
- 249983
- Nikkaji
- J3.161.714F
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 13 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 79.3
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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