4,4'-(1,6-Hexanediyl)dioxydianiline
Basic information
- CAS
47244-09-7- Standard SMILES
Nc1ccc(OCCCCCCOc2ccc(N)cc2)cc1- InChIKey
GRFCDFDVGOXFPY-UHFFFAOYSA-N- Molecular formula
- C18H24N2O2
- Average molar mass
- 300.4 g/mol
- Monoisotopic mass
- 300.18377801
Overview
See also: 2,2'-(Hexamethylenedioxy)dianiline (annotation moved to).
Names & identifiers
- Preferred name
- 4,4'-(1,6-Hexanediyl)dioxydianiline
- IUPAC
- 4-[6-(4-aminophenoxy)hexoxy]aniline
- English name
- 4,4'-(1,6-Hexanediyl)dioxydianiline
- Molecular formula
- C18H24N2O2
- Molecular weight
- 300.4
Names & synonyms
4,4'-(1,6-hexanediyl)dioxydianiline47244-09-74-[6-(4-aminophenoxy)hexoxy]aniline4,4'-[Hexane-1,6-diylbis(oxy)]dianilineMFCD106987354,4'-(hexane-1,6-diylbis(oxy))dianilineSCHEMBL4021206DTXSID80274742GRFCDFDVGOXFPY-UHFFFAOYSA-NAKOS0243904914,4'-(Hexane-1,6-diyldioxy)dianilineSY465774
Show more names
2,2'-(HEXAMETHYLENEDIOXY)DIANILINE2,2'-(HEXAMETHYLENEDIOXY)DIANILINE4-[6-(4'-4-aminophenoxy)hexoxy]aniline4,4''-(1,6-HEXANEDIYL)DIOXYDIANILINE ,98%Benzenamine, 4,4'-[1,6-hexanediylbis(oxy)]bis- (9CI)
4-[6-(4-aminophenoxy)hexyloxy]phenylamineHexan-1,6-diol, o,o'-bis[4-aminophenyl]-ST510457374-([6-(4-Aminophenoxy)hexyl]oxy)aniline #H599344,4 inverted exclamation mark -[Hexane-1,6-diylbis(oxy)]dianiline
Database identifiers
- CAS
47244-09-7- PubChem CID
- 23320
- DTXSID
DTXSID80274742- Nikkaji
- J718.027F
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 70.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 244
Physicochemical properties
- Melting point
- 138 · 138-139 °C
- Boiling point
- 518.7 · 518.7±35.0 °C(Predicted)
- Density
- 1.117 · 1.117±0.06 g/cm3(Predicted)
- pka
- 5.53 · 5.53±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS09,GHS05
- Signal word
- Danger
- Hazard statements
- 335 · H335-H315-H400-H318
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310-P273-P391-P501
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
- Danger
- Symbol(GHS)
- GHS07,GHS09,GHS05
- Hazard statements
- H335-H315-H400-H318
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310-P273-P391-P501
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Compound notes
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