N'-(2,3-dimethoxybenzyl)-N,N-dimethylpropane-1,3-diamine dihydrochloride
Basic information
- CAS
121177-60-4- Standard SMILES
COc1cccc(CNCCCN(C)C)c1OC- InChIKey
JUTCZTNZSSFDGQ-UHFFFAOYSA-N- Molecular formula
- C14H24N2O2
- Average molar mass
- 252.35 g/mol
- Monoisotopic mass
- 252.18377801
Names & identifiers
- Preferred name
- N'-(2,3-dimethoxybenzyl)-N,N-dimethylpropane-1,3-diamine dihydrochloride
- IUPAC
- N-[(2,3-dimethoxyphenyl)methyl]-N',N'-dimethylpropane-1,3-diamine
- English name
- N-(2,3-Dimethoxy-benzyl)-N,N-dimethyl-propane-1,3-diamine
- Molecular formula
- C14H24N2O2
- Molecular weight
- 252.35
Names & synonyms
121177-60-4N1-(2,3-Dimethoxybenzyl)-N3,N3-dimethylpropane-1,3-diamineN'-(2,3-dimethoxybenzyl)-N,N-dimethylpropane-1,3-diamine dihydrochloride[(2,3-dimethoxyphenyl)methyl][3-(dimethylamino)propyl]amineN'-(2,3-dimethoxybenzyl)-N,N-dimethylpropane-1,3-diamineN-[(2,3-dimethoxyphenyl)methyl]-N',N'-dimethylpropane-1,3-diamine1,3-propanediamine, N'-[(2,3-dimethoxyphenyl)methyl]-N,N-dimethyl-, dihydrochlorideALBB-015433MFCD07407131N-[(2,3-dimethoxyphenyl)methyl]-N',N'-dimethyl-propane-1,3-diamineSTK728709AKOS000244143
Show more names
N-(2,3-Dimethoxy-benzyl)-N,N-dimethyl-propane-1,3-diamine1,3-Propanediamine, N3-[(2,3-dimethoxyphenyl)methyl]-N1,N1-dimethyl-[(2,3-dimethoxyphenyl)methyl][3-(dimethylamino)propyl]amine dihydrochloride
VS-10051CS-0300325EN300-302553N~3~-[(2,3-dimethoxyphenyl)methyl]-N~1~,N~1~-dimethylpropane-1,3-diamine--hydrogen chloride (1/2)
Database identifiers
- CAS
121177-60-4- PubChem CID
- 4718872
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 33.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 212
Physicochemical properties
- Boiling point
- 336.1 · 336.1±37.0 °C(Predicted)
- Density
- 0.999 · 0.999±0.06 g/cm3(Predicted)
- pka
- 9.57 · 9.57±0.28(Predicted)
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…