Benzyl(dodecyl)amine
Basic information
- CAS
1687-68-9- Standard SMILES
CCCCCCCCCCCCNCc1ccccc1- InChIKey
TWOFDIYIPNBWBG-UHFFFAOYSA-N- Molecular formula
- C19H33N
- Average molar mass
- 275.5 g/mol
- Monoisotopic mass
- 275.26130006
Overview
See also: Benzyldodecylamine (annotation moved to).
Names & identifiers
- Preferred name
- Benzyl(dodecyl)amine
- IUPAC
- N-benzyldodecan-1-amine
- English name
- Benzyldodecylamine
- Molecular formula
- C19H33N
- Molecular weight
- 275.47
Names & synonyms
benzyl(dodecyl)aminen-benzyldodecan-1-amine1687-68-9N-DodecylbenzenemethanamineN-benzyl-n-dodecylamineBenzenemethanamine, N-dodecyl-MFCD00093619Benzyldodecylaminen-dodecylbenzylaminedodecylbenzylamineN-LaurylbenzylamineNSC30887
Show more names
N-BenzyldodecylamineDodecylamine, N-benzyl-Q7KA7EZE5UBenzenemethanamine,n-dodecyl-SCHEMBL1683345SCHEMBL10821498DTXSID20937521TWOFDIYIPNBWBG-UHFFFAOYSA-N
Database identifiers
- CAS
1687-68-9- PubChem CID
- 232909
- DTXSID
DTXSID20937521- UNII
- Q7KA7EZE5U
- Nikkaji
- J28.350I
Properties
Computed structural properties
- XLogP
- 6.9
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 13
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 184
Physicochemical properties
- Melting point
- 185 · 185-188 °C
- Boiling point
- 185 · 185-190 °C(Press: 2 Torr)
- Density
- 0.8842 g/cm3 · 0.8842 g/cm3
- pka
- 9.79 · 9.79±0.19(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 413 · H413-H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H413-H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P
Related reactions
2 records
Compound notes
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