Basic information
- CAS
172914-28-2- Standard SMILES
Cc1cccc(Nc2c([N+](=O)[O-])sc3ccccc23)c1- InChIKey
VZUHXOLMSVZQSH-UHFFFAOYSA-N- Molecular formula
- C15H12N2O2S
- Average molar mass
- 284.3 g/mol
- Monoisotopic mass
- 284.0619488
Names & identifiers
- Preferred name
- Benzo(b)thiophen-3-amine, N-(3-methylphenyl)-2-nitro-
- IUPAC
- N-(3-methylphenyl)-2-nitro-1-benzothiophen-3-amine
- English name
- N-(3-Methylphenyl)-2-nitrobenzo(b)thiophen-3-amine
- Molecular weight
- 0
Names & synonyms
172914-28-2N-(3-Methylphenyl)-2-nitrobenzo(b)thiophen-3-amineBenzo(b)thiophen-3-amine, N-(3-methylphenyl)-2-nitro-N-(3-METHYLPHENYL)-2-NITROBENZO[B]THIOPHEN-3-AMINEDTXSID90169433RefChem:326175DTXCID6091924N-(3-methylphenyl)-2-nitro-1-benzothiophen-3-amine
Database identifiers
- CAS
172914-28-2- PubChem CID
- 154014
- DTXSID
DTXSID90169433- Nikkaji
- J693.647D
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 86.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 360
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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