Basic information
- CAS
24318-43-2- Standard SMILES
COc1ccc(COC(=O)c2ccc(OC)cc2)cc1- InChIKey
PUXJRQHDLYGOCY-UHFFFAOYSA-N- Molecular formula
- C16H16O4
- Average molar mass
- 272.29 g/mol
- Monoisotopic mass
- 272.10485899
Names & identifiers
- Preferred name
- p-Methoxybenzyl p-anisate
- IUPAC
- (4-methoxyphenyl)methyl 4-methoxybenzoate
- English name
- p-methoxybenzyl p-anisate
- Molecular formula
- C16H16O4
- Molecular weight
- 272.3
Names & synonyms
p-Methoxybenzyl p-anisate24318-43-24-methoxybenzyl 4-methoxybenzoate(4-methoxyphenyl)methyl 4-methoxybenzoateMH827WPN5XEINECS 246-159-1NSC-78835Benzoic acid, 4-methoxy-, (4-methoxyphenyl)methyl esterAI3-18958DTXSID20179060NSC 78835P-ANISIC ACID, P-METHOXYBENZYL ESTER
Show more names
4-Methoxybenzoic acid 4-methoxybenzyl ester
BENZYL ALCOHOL, P-METHOXY-, P-ANISATERefChem:169354p-Methoxybenzyl p-anisic acidDTXCID50101551(4-Methoxyphenyl)methyl 4-methoxybenzoic acid246-159-1NSC78835UNII-MH827WPN5X
Database identifiers
- CAS
24318-43-2- PubChem CID
- 90465
- DTXSID
DTXSID20179060- UNII
- MH827WPN5X
- EC Number
- 246-159-1
- Nikkaji
- J287.209I
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 289
Physicochemical properties
- FDA UNII
- 827 WPN5X · MH827WPN5X
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers1 total
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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