Basic information
- CAS
356093-66-8- Standard SMILES
COc1cc(CNC2CCCCC2)cc(OC)c1- InChIKey
JVKDFAYHZSCPFF-UHFFFAOYSA-N- Molecular formula
- C15H23NO2
- Average molar mass
- 249.35 g/mol
- Monoisotopic mass
- 249.17287898
Names & identifiers
- Preferred name
- N-(3,5-dimethoxybenzyl)cyclohexanamine
- IUPAC
- N-[(3,5-dimethoxyphenyl)methyl]cyclohexanamine
- English name
- CHEMBRDG-BB 5573124
- Molecular formula
- C15H23NO2
- Molecular weight
- 249.35
Names & synonyms
N-(3,5-dimethoxybenzyl)cyclohexanamine356093-66-8N-[(3,5-dimethoxyphenyl)methyl]cyclohexanamineOprea1_009658Oprea1_351422DTXSID20354512STK145789AKOS000222952DB-188358[(3,5-dimethoxyphenyl)methyl]cyclohexylamineST45158625AB00089853-01
Show more names
CHEMBRDG-BB 5573124UKRORGSYN-BB BBV-118664N-Cyclohexyl-3,5-dimethoxybenzenemethanamineBenzenemethanamine, N-cyclohexyl-3,5-dimethoxy-N-(3,5-dimethoxybenzyl)cyclohexanamine(SALTDATA: HBr)
AG-690/13701777SR-01000214081SR-01000214081-1
Database identifiers
- CAS
356093-66-8- PubChem CID
- 775271
- DTXSID
DTXSID20354512
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 30.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 217
Physicochemical properties
- Boiling point
- 373.8 · 373.8±27.0 °C(Predicted)
- Density
- 1.04 · 1.04±0.1 g/cm3(Predicted)
- pka
- 9.67 · 9.67±0.20(Predicted)
Chemistry & industry
Suppliers1 total
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…