Basic information
- CAS
355382-21-7- Standard SMILES
COc1ccc(CNCc2cccnc2)cc1- InChIKey
GFVGRXRPLSBJFO-UHFFFAOYSA-N- Molecular formula
- C14H16N2O
- Average molar mass
- 228.29 g/mol
- Monoisotopic mass
- 228.12626314
Names & identifiers
- Preferred name
- (4-Methoxy-benzyl)-pyridin-3-ylmethyl-amine
- IUPAC
- 1-(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)methanamine
- English name
- (4-METHOXY-BENZYL)-PYRIDIN-3-YLMETHYL-AMINE
- Molecular formula
- C14H16N2O
- Molecular weight
- 228.29
Names & synonyms
355382-21-7(4-Methoxy-benzyl)-pyridin-3-ylmethyl-amineN-(4-Methoxybenzyl)-1-(pyridin-3-yl)methanamine1-(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)methanamine1-(4-methoxyphenyl)-N-(3-pyridylmethyl)methanamine[(4-methoxyphenyl)methyl][(pyridin-3-yl)methyl]amine[(4-methoxyphenyl)methyl](3-pyridylmethyl)amineCBMicro_023369Oprea1_030635Oprea1_784154SCHEMBL1043015DTXSID40355122
Show more names
AKOS B023235TIMTEC-BB SBB007245ART-CHEM-BB B023235N-[(4-Methoxyphenyl)methyl]-3-pyridinemethanamine3-Pyridinemethanamine, N-[(4-methoxyphenyl)methyl]-
BBL013843CCG-10786MFCD01135495SBB007245STL194205AKOS000233369VS-04017BIM-0023421.P001
Database identifiers
- CAS
355382-21-7- PubChem CID
- 791920
- DTXSID
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 34.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 202
Physicochemical properties
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
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
- hazard_code
- Xi
- hazard_class
- IRRITANT
Chemistry & industry
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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