Basic information
- CAS
1060816-49-0- Standard SMILES
Cc1cc2c(cn1)CCNC2- InChIKey
YQHGLRPIWLABNQ-UHFFFAOYSA-N- Molecular formula
- C9H12N2
- Average molar mass
- 148.2 g/mol
- Monoisotopic mass
- 148.10004839
Names & identifiers
- Preferred name
- 7-Methyl-1,2,3,4-tetrahydro-2,6-naphthyridine
- IUPAC
- 7-methyl-1,2,3,4-tetrahydro-2,6-naphthyridine
- English name
- 7-Methyl-1,2,3,4-tetrahydro-[2,6]naphthyridine
- Molecular formula
- C9H12N2
- Molecular weight
- 148.21
Names & synonyms
1060816-49-07-METHYL-1,2,3,4-TETRAHYDRO-2,6-NAPHTHYRIDINE1,2,3,4-Tetrahydro-7-methyl-2,6-naphthyridineSCHEMBL18977627DTXSID801253589AB68344DB-1469137-Methyl-1,2,3,4-tetrahydro-[2,6]naphthyridine2,6-Naphthyridine, 1,2,3,4-tetrahydro-7-methyl-
Database identifiers
- CAS
1060816-49-0- PubChem CID
- 72212331
- DTXSID
DTXSID801253589
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 24.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 136
Physicochemical properties
- Boiling point
- 248 · 248.0±35.0 °C(Predicted)
- Density
- 1.045 · 1.045±0.06 g/cm3(Predicted)
- pka
- 7.77 · 7.77±0.20(Predicted)
Chemistry & industry
Suppliers2 total
上海威芬奇医药科技有限公司13817485796 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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