N-(alpha-Trichloromethyl-4-methoxybenzyl)-4-methoxyaniline
Basic information
- CAS
38766-64-2- Standard SMILES
COc1ccc(NC(c2ccc(OC)cc2)C(Cl)(Cl)Cl)cc1- InChIKey
GEJROUPAAFMDDK-UHFFFAOYSA-N- Molecular formula
- C16H16Cl3NO2
- Average molar mass
- 360.7 g/mol
- Monoisotopic mass
- 359.024662
Overview
structure
Names & identifiers
- Preferred name
- N-(alpha-Trichloromethyl-4-methoxybenzyl)-4-methoxyaniline
- IUPAC
- 4-methoxy-N-[2,2,2-trichloro-1-(4-methoxyphenyl)ethyl]aniline
Names & synonyms
38766-64-2N-(alpha-Trichloromethyl-p-methoxybenzyl)-p-methoxyanilineN-(alpha-Trichloromethyl-4-methoxybenzyl)-4-methoxyaniline4-Methoxy-N-(4-methoxyphenyl)-alpha-(trichloromethyl)benzenemethanamineRefChem:1623044-methoxy-N-[2,2,2-trichloro-1-(4-methoxyphenyl)ethyl]anilineDTXSID10959570Benzenemethanamine, 4-methoxy-N-(4-methoxyphenyl)-alpha-(trichloromethyl)-
Database identifiers
- CAS
38766-64-2- PubChem CID
- 38092
- DTXSID
DTXSID10959570- Nikkaji
- J1.619.296A
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 30.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 322
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Compound notes
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