Basic information
- CAS
28537-85-1- Standard SMILES
CCCCCCCC(=O)[O-].CCCC[NH2+]CCCC- InChIKey
BNAITARODKBTDD-UHFFFAOYSA-N- Molecular formula
- C16H35NO2
- Average molar mass
- 273.45 g/mol
- Monoisotopic mass
- 273.26677936
Overview
See also: Octanoic acid, compound with dibutylamine (1:1) (preferred).
Names & identifiers
- Preferred name
- Dibutylazanium;octanoate
- IUPAC
- dibutylazanium;octanoate
- English name
- octanoic acid, compound with dibutylamine (1:1)
- Molecular formula
- C16H35NO2
- Molecular weight
- 273.46
Names & synonyms
dibutylamine octanoatedi-N-butylamine caprylateoctanoic acid, compound with dibutylamine (1:1)Octanoic acid, compd. with N-butyl-1-butanamine (1:1) (9CI, ACI)
Database identifiers
- CAS
28537-85-1- PubChem CID
- 19905035
Properties
Computed structural properties
- Topological polar surface area
- 56.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 11
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 122
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Warning
- Hazard statements
- 318 · H318-H315-H302
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310-P264-P270-P301+P312-P330-P501
- REACH Registrations
- Inactive
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,GHS05
- Hazard statements
- H318-H315-H302
- REACH Registrations
- Inactive
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310-P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers2 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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