Basic information
- CAS
418777-08-9- Standard SMILES
COCC(C)NCc1cccc(OC)c1- InChIKey
RPSBMRKZOPGLSG-UHFFFAOYSA-N- Molecular formula
- C12H19NO2
- Average molar mass
- 209.28 g/mol
- Monoisotopic mass
- 209.14157885
Names & identifiers
- Preferred name
- (3-Methoxybenzyl)(2-methoxy-1-methylethyl)amine
- IUPAC
- 1-methoxy-N-[(3-methoxyphenyl)methyl]propan-2-amine
- English name
- (3-METHOXY-BENZYL)-(2-METHOXY-1-METHYL-ETHYL)-AMINE
- Molecular formula
- C12H19NO2
- Molecular weight
- 209.28
Names & synonyms
418777-08-91-methoxy-N-(3-methoxybenzyl)propan-2-amine(3-methoxybenzyl)(2-methoxy-1-methylethyl)amine[(3-methoxyphenyl)methyl](1-methoxypropan-2-yl)amine1-methoxy-N-[(3-methoxyphenyl)methyl]propan-2-amine(2-methoxy-isopropyl)[(3-methoxyphenyl)methyl]amine(3-Methoxy-benzyl)-(2-methoxy-1-methyl-ethyl)-amineCambridge id 5542606TimTec1_007392Oprea1_360941Oprea1_565214DTXSID20386035
Show more names
AKOS B023227ART-CHEM-BB B023227CHEMBRDG-BB 5542606TIMTEC-BB SBB007238UKRORGSYN-BB BBV-123882(3-Methoxy-benzyl)-(2-methoxy-1-methyl-ethyl)-aminBenzenemethanamine, 3-methoxy-N-(2-methoxy-1-methylethyl)-
HMS1554P22BBL018634MFCD01454610SBB007238STK193453AKOS000230884AKOS017124937SB78685
Database identifiers
- CAS
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 30.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 164
Physicochemical properties
- Boiling point
- 288.1 · 288.1±20.0 °C(Predicted)
- Density
- 0.99 · 0.990±0.06 g/cm3(Predicted)
- pka
- 8.82 · 8.82±0.19(Predicted)
Chemistry & industry
Suppliers1 total
Aladdin Scientific[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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