Naphthol AS-MX butyrate
Basic information
- CAS
137629-33-5- Standard SMILES
CCCC(=O)Oc1cc2ccccc2cc1C(=O)Nc1ccc(C)cc1C- InChIKey
OSBXUQZQTBGULF-UHFFFAOYSA-N- Molecular formula
- C23H23NO3
- Average molar mass
- 361.4 g/mol
- Monoisotopic mass
- 361.1677936
Names & identifiers
- Preferred name
- Naphthol AS-MX butyrate
- IUPAC
- [3-[(2,4-dimethylphenyl)carbamoyl]naphthalen-2-yl] butanoate
- English name
- Naphthol as-mx butyrate
- Molecular formula
- C23H23NO3
- Molecular weight
- 361.43
Names & synonyms
Naphthol AS-MX butyrate137629-33-5[3-[(2,4-dimethylphenyl)carbamoyl]naphthalen-2-yl] ButanoateDTXSID50394885AKOS024374968DB-042398ST510150733-[(2,4-dimethylphenyl)carbamoyl]naphthalen-2-yl butanoate3-[N-(2,4-dimethylphenyl)carbamoyl]-2-naphthyl butanoatenapthol as-mx butyrateButanoic acid, 3-[[(2,4-dimethylphenyl)amino]carbonyl]-2-naphthalenyl ester
Database identifiers
- CAS
137629-33-5- PubChem CID
- 3672370
- DTXSID
DTXSID50394885
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 520
Physicochemical properties
- storage temp.
- 20 °C · −20°C
- WGK Germany
- 3 · 3
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
- wgk
- 3
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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