Basic information
- CAS
20198-87-2- Standard SMILES
CCCCCCCCCCCCCCCCCCNCc1ccccc1- InChIKey
OALZJIBCZVVPBY-UHFFFAOYSA-N- Molecular formula
- C25H45N
- Average molar mass
- 359.6 g/mol
- Monoisotopic mass
- 359.35520044
Names & identifiers
- Preferred name
- Benzenemethanamine, N-octadecyl-
- IUPAC
- N-benzyloctadecan-1-amine
- English name
- N-octadecylbenzylamine
- Molecular formula
- C25H45N
- Molecular weight
- 359.63
Names & synonyms
N-BenzyloctadecylamineBenzenemethanamine, N-octadecyl-EINECS 243-584-4RefChem:563346N-Octadecylbenzylamine20198-87-2N-OCTADECYLBENZENEMETHANAMINEN-StearylbenzylamineN-benzyloctadecan-1-amineN-benzyl-octadecyl amineSCHEMBL339686796JE2FM9V
Show more names
DTXSID2066567NS00026547H60981
Database identifiers
- CAS
20198-87-2- PubChem CID
- 88404
- DTXSID
DTXSID2066567- UNII
- 796JE2FM9V
- EC Number
- 243-584-4
- Nikkaji
- J28.354A
Properties
Computed structural properties
- XLogP
- 10.1
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 19
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 257
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- EPA Substance Registry System
- N-Stearylbenzylamine (20198-87-2)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- TSCA
- TSCA listed
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
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzenemethanamine, N-octadecyl-: INACTIVE
Suppliers4 total
郑州格镭生物科技有限公司19903857099; 19937938981 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 18651614124 · [email protected]
Related reactions
2 records
Compound notes
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