Basic information
- CAS
24098-77-9- Standard SMILES
COc1ccc(-c2ccc(CCC(=O)[O-])o2)cc1- InChIKey
ZKWNOAWLDSIWEE-UHFFFAOYSA-M- Molecular formula
- C14H13O4-
- Average molar mass
- 245.25 g/mol
- Monoisotopic mass
- 245.08138389
Names & identifiers
- Preferred name
- 3-[5-(4-Methoxyphenyl)furan-2-yl]propanoate
- IUPAC
- 3-[5-(4-methoxyphenyl)furan-2-yl]propanoate
- English name
- 3-[5-(4-Methoxy-phenyl)-furan-2-yl]-propionic acid
- Molecular formula
- C14H14O4
- Molecular weight
- 246.26
Names & synonyms
3-[5-(4-methoxyphenyl)furan-2-yl]propanoateDTXSID209469312-Furanpropanoic acid, 5-(4-methoxyphenyl)-3-[5-(4-methoxyphenyl)-2-furanyl]propanoate3-[5-(4-METHOXYPHENYL)-2-FURYL]PROPANOIC ACID3-[5-(4-methoxyphenyl)furan-2-yl]propanoic acid3-[5-(4-Methoxy-phenyl)-furan-2-yl]-propionic acid
Database identifiers
- CAS
24098-77-9- PubChem CID
- 3678281
- DTXSID
DTXSID20946931
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 62.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- -1
- Complexity
- 265
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H312-H332
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
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_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H302-H312-H332
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
Chemistry & industry
Suppliers4 total
Aladdin Scientific[email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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