1,2,3,4-Tetrahydro-2,7-naphthyridine
Basic information
- CAS
108749-08-2- Standard SMILES
c1cc2c(cn1)CNCC2- InChIKey
OZTPQWRLHLQVBD-UHFFFAOYSA-N- Molecular formula
- C8H10N2
- Average molar mass
- 134.18 g/mol
- Monoisotopic mass
- 134.08439833
Names & identifiers
- Preferred name
- 1,2,3,4-Tetrahydro-2,7-naphthyridine
- IUPAC
- 1,2,3,4-tetrahydro-2,7-naphthyridine
- English name
- 1,2,3,4-Tetrahydro-[2,7]naphthyridine
- Molecular formula
- C8H10N2
- Molecular weight
- 134.18
Names & synonyms
1,2,3,4-TETRAHYDRO-2,7-NAPHTHYRIDINE108749-08-2DTXSID40591043RefChem:214450DTXCID005418071,2,3,4-TETRAHYDRO-[2,7]NAPHTHYRIDINE2,7-NAPHTHYRIDINE, 1,2,3,4-TETRAHYDRO-MFCD08752596tetrahydro-2,7-naphthyridineSCHEMBL587887SCHEMBL966730SCHEMBL2119171
Show more names
1,2,3,4-Tetrahydro-2,7phthyridine2,7-Naphthyridine, 1,2,3,4-tetrahydro1,2,3,4-Tetrahydro-2,7-naphthyridine ,95%2,7-Naphthyridine,1,2,3,4-tetrahydro-(9CI)
SCHEMBL2119174SCHEMBL2264431SCHEMBL21591581SCHEMBL21591683SCHEMBL23301496SCHEMBL29850369OZTPQWRLHLQVBD-UHFFFAOYSA-NSTR11614
Database identifiers
- CAS
108749-08-2- PubChem CID
- 17801413
- DTXSID
DTXSID40591043- Nikkaji
- J777.738H
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 24.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 114
Physicochemical properties
- Melting point
- 248 · 248-250 °C(Solv: water (7732-18-5))
- Boiling point
- 244.5 · 244.5±30.0 °C(Predicted)
- Density
- 1.068 · 1.068±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- pka
- 7.93 · 7.93±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- HS Code
- 29339900 · 29339900
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
- hs_code
- 29339900
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Related reactions
5 records
Compound notes
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