Basic information
- CAS
16494-25-0- Standard SMILES
CCCCCC(=O)Oc1ccc(N=Nc2ccc(OCC)cc2)cc1- InChIKey
RMMPLQWQSVPJON-UHFFFAOYSA-N- Molecular formula
- C20H24N2O3
- Average molar mass
- 340.4 g/mol
- Monoisotopic mass
- 340.17869263
Names & identifiers
- Preferred name
- Hexanoic acid, 4-[2-(4-ethoxyphenyl)diazenyl]phenyl ester
- IUPAC
- [4-[(4-ethoxyphenyl)diazenyl]phenyl] hexanoate
- English name
- Hexanoic acid 4'-ethoxyazobenzene-4-yl ester
- Molecular formula
- C20H24N2O3
- Molecular weight
- 340.42
Names & synonyms
Hexanoic acid, 4-((4-ethoxyphenyl)azo)phenyl ester16494-25-0Hexanoic acid, 4-[(4-ethoxyphenyl)azo]phenyl esterHexanoic acid, 4-(2-(4-ethoxyphenyl)diazenyl)phenyl esterHexanoic acid, 4-[2-(4-ethoxyphenyl)diazenyl]phenyl esterRefChem:787381[4-[(4-ethoxyphenyl)diazenyl]phenyl] hexanoateSCHEMBL8404989SCHEMBL8404991DTXSID2066068RMMPLQWQSVPJON-UHFFFAOYSA-N4-(4'-ethoxyphenylazo)phenyl hexanoate
Show more names
p-(p-Ethoxyphenylazo)phenyl hexanoateHexanoic acid 4-ethoxyazobenzene-4'-yl esterHexanoic acid 4'-ethoxyazobenzene-4-yl esterHexanoic acid 4-(4-ethoxyphenylazo)phenyl esterHexanoic acid p-(p-ethoxyphenylazo)phenyl esterHexanoic acid 4-[(4-ethoxyphenyl)azo]phenyl ester
4-[(4-Ethoxyphenyl)diazenyl]phenyl hexanoate
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 60.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 398
Physicochemical properties
- CAS DataBase Reference
- 16494 · 16494-25-0
- EPA Substance Registry System
- 4 · Hexanoic acid, 4-[(4-ethoxyphenyl)azo]phenyl ester (16494-25-0)
- 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
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationHexanoic acid, 4-[2-(4-ethoxyphenyl)diazenyl]phenyl ester: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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