Allylamine, N-methyl-3,3-diphenyl-, hydrochloride
Basic information
- CAS
21912-88-9- Standard SMILES
CNCC=C(c1ccccc1)c1ccccc1.Cl- InChIKey
DFPFDNHWEJASOG-UHFFFAOYSA-N- Molecular formula
- C16H18ClN
- Average molar mass
- 259.77 g/mol
- Monoisotopic mass
- 259.1127773
Names & identifiers
- Preferred name
- Allylamine, N-methyl-3,3-diphenyl-, hydrochloride
- IUPAC
- N-methyl-3,3-diphenylprop-2-en-1-amine;hydrochloride
Names & synonyms
21912-88-9Allylamine, N-methyl-3,3-diphenyl-, hydrochlorideRefChem:1076374BW-2471,1-Diphenyl-3-methylaminoprop-1-ene hydrochlorideBW 247Propene, 1,1-diphenyl-3-methylamino-, hydrochloride2-Propen-1-amine, 3,3-diphenyl-N-methyl-, hydrochlorideDTXSID20944513BW247N-Methyl-3,3-diphenylprop-2-en-1-amine--hydrogen chloride (1/1)
Database identifiers
- CAS
21912-88-9- PubChem CID
- 89549
- DTXSID
DTXSID20944513
Properties
Computed structural properties
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 212
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Compound notes
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