Basic information
- CAS
427885-85-6- Standard SMILES
COc1cc(-c2cc(CCl)ccn2)cc(OC)c1OC- InChIKey
SBGHNDCBGPREJJ-UHFFFAOYSA-N- Molecular formula
- C15H16ClNO3
- Average molar mass
- 293.74 g/mol
- Monoisotopic mass
- 293.08187105
Names & identifiers
- Preferred name
- 4-Chloromethyl-2-(3,4,5-trimethoxyphenyl) pyridine
- IUPAC
- 4-(chloromethyl)-2-(3,4,5-trimethoxyphenyl)pyridine
- English name
- 4-(CHLOROMETHYL)-2-(3,4,5-TRIMETHOXYPHENYL)PYRIDINE
- Molecular formula
- C15H16ClNO3
- Molecular weight
- 293.75
Names & synonyms
4-chloromethyl-2-(3,4,5-trimethoxyphenyl) pyridine427885-85-64-(chloromethyl)-2-(3,4,5-trimethoxyphenyl)pyridineSCHEMBL4120272DTXSID70475928SBGHNDCBGPREJJ-UHFFFAOYSA-N4-chloromethyl-2-( 3,4,5-trimethoxyphenyl)pyridine4-chloromethyl-2-(3,4,5-trimethoxyphenyl)-pyridine4-Chloromethyl-2-(3,4,5-trimethoxyphenyl)pyridinePyridine, 4-(chloromethyl)-2-(3,4,5-trimethoxyphenyl)-
Database identifiers
- CAS
427885-85-6- PubChem CID
- 12019237
- DTXSID
DTXSID70475928
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 40.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 278
Related reactions
141 records
Compound notes
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