Basic information
- Standard SMILES
Cc1cc(-c2ccc[nH]2)nc2ccccc12- InChIKey
MPDDNFGDFVFSHQ-UHFFFAOYSA-N- Molecular formula
- C14H12N2
- Average molar mass
- 208.26 g/mol
- Monoisotopic mass
- 208.10004838
Names & identifiers
- Preferred name
- 4-methyl-2-(1H-pyrrol-2-yl)quinoline
- IUPAC
- 4-methyl-2-(1H-pyrrol-2-yl)quinoline
- English name
- 4-METHYL-2-(1H-PYRROL-2-YL)QUINOLINE
- Molecular formula
- C14H12N2
- Molecular weight
- 208.25848
Names & synonyms
4-methyl-2-(1H-pyrrol-2-yl)quinoline943825-14-7DTXSID70368740RefChem:294150DTXCID30319778
Database identifiers
- CAS
943825-14-7- PubChem CID
- 2457865
- DTXSID
DTXSID70368740- Nikkaji
- J2.463.126E
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 28.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 241
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Linked notes
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