Basic information
- CAS
24964-09-8- Standard SMILES
Cc1cccc2cc3c(cc12)sc1ccccc13- InChIKey
CKOZCPVQNQOFGX-UHFFFAOYSA-N- Molecular formula
- C17H12S
- Average molar mass
- 248.3 g/mol
- Monoisotopic mass
- 248.06597156
Names & identifiers
- Preferred name
- 7-Methylbenzo[b]naphtho[2,3-d]thiophene
- IUPAC
- 7-methylnaphtho[2,3-b][1]benzothiole
- English name
- 7-Methylbenzo[b]naphtho[2,3-d]thiophene
- Molecular formula
- C17H12S
- Molecular weight
- 248.34
Names & synonyms
7-Methylbenzo[b]naphtho[2,3-d]thiophene7-Methylbenzo[b]naptho[2,3-d]thiopheneBenzo(b)naphtho(2,3-d)thiophene, 7-methyl-Benzo[b]naphtho[2,3-d]thiophene, 7-methyl-9-Methyl-11-thiabenzo(b)fluorene9-Methyl-11-thiabenzo[b]fluorene7-Methylnaphtho(2,3-b)benzothiophene7-Methylbenzo(b)naphtho(2,3-d)thiophene7-Methylnaphtho[2,3-b][1]benzothiopheneDTXSID70179676NSC 333987-Methylnaphtho[2,3-b]benzothiophene
Show more names
Benzo[b]naphtho[2,3]thiophene, 7-methyl7-Methylbenzo[b]naphtho[2,3-d]thiophene in toluene
7-Methylbenzo(b)naptho(2,3-d)thiophene7-Methylnaphtho(2,3-b)(1)benzothiopheneRefChem:311077DTXCID30102167CKOZCPVQNQOFGX-UHFFFAOYSA-N24964-09-87-methylnaphtho[2,3-b][1]benzothioleNSC33398
Database identifiers
- CAS
24964-09-8- PubChem CID
- 90669
- DTXSID
DTXSID70179676
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 28.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 313
Physicochemical properties
- Melting point
- 175 · 175-176 °C
- Boiling point
- 446.5 · 446.5±14.0 °C(Predicted)
- Density
- 1.257 · 1.257±0.06 g/cm3(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers2 total
江苏南创化学与生命健康研究院有限公司15720605021 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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