Methyl 4-((4-formyl-2-methoxyphenoxy)methyl)benzoate
Basic information
- CAS
351336-10-2- Standard SMILES
COC(=O)c1ccc(COc2ccc(C=O)cc2OC)cc1- InChIKey
SXQFUFPFCNTWEB-UHFFFAOYSA-N- Molecular formula
- C17H16O5
- Average molar mass
- 300.3 g/mol
- Monoisotopic mass
- 300.09977361
Names & identifiers
- Preferred name
- Methyl 4-((4-formyl-2-methoxyphenoxy)methyl)benzoate
- IUPAC
- methyl 4-[(4-formyl-2-methoxyphenoxy)methyl]benzoate
- English name
- Benzoic acid, 4-[(4-formyl-2-methoxyphenoxy)methyl]-, methyl ester
- Molecular formula
- C17H16O5
- Molecular weight
- 300.31
Names & synonyms
351336-10-2methyl 4-[(4-formyl-2-methoxyphenoxy)methyl]benzoateMethyl 4-((4-formyl-2-methoxyphenoxy)methyl)benzoateRefChem:815780999-690-2methyl 4-(4-formyl-2-methoxyphenoxymethyl)benzoateMFCD01893327C17H16O54-(4-Formyl-2-methoxy-phenoxymethyl)-benzoic acid methyl esterOprea1_696345SCHEMBL25204779BPA33610
Show more names
Benzoic acid, 4-[(4-formyl-2-methoxyphenoxy)methyl]-, methyl ester
SBB027102STL406651AKOS000115399CS-0218462ST45136271EN300-01046G30181methyl4-(4-formyl-2-methoxyphenoxymethyl)benzoate
Database identifiers
- CAS
351336-10-2- PubChem CID
- 877933
- EC Number
- 999-690-2
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 362
Physicochemical properties
- Boiling point
- 464.7 · 464.7±40.0 °C(Predicted)
- Density
- 1.212 · 1.212±0.06 g/cm3(Predicted)
- 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.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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