3,3-Bis(4-methoxyphenyl)phthalide
Basic information
- CAS
6315-80-6- Standard SMILES
COc1ccc(C2(c3ccc(OC)cc3)OC(=O)c3ccccc32)cc1- InChIKey
ACLVEZCDKFXULE-UHFFFAOYSA-N- Molecular formula
- C22H18O4
- Average molar mass
- 346.4 g/mol
- Monoisotopic mass
- 346.12050905
Names & identifiers
- Preferred name
- 3,3-Bis(4-methoxyphenyl)phthalide
- IUPAC
- 3,3-bis(4-methoxyphenyl)-2-benzofuran-1-one
- English name
- 4,4'-[1(3H)-Oxoisobenzofuran-3-ylidene]bisanisole
- Molecular formula
- C22H18O4
- Molecular weight
- 346.38
Names & synonyms
3,3-Bis(4-methoxyphenyl)phthalide6315-80-6DTXSID102812621(3H)-Isobenzofuranone, 3,3-bis(4-methoxyphenyl)-RefChem:90770DTXCID10232416ACLVEZCDKFXULE-UHFFFAOYSA-N3,3-Bis(4-methoxyphenyl)isobenzofuran-1(3H)-one3,3-bis(4-methoxyphenyl)-2-benzofuran-1-oneNSC21021Phenolphthaleine dimethyl etherSCHEMBL3891626
Show more names
Phenolphthalein dimethyl ether3,3-Bis(4-methoxyphenyl)-1(3H)-isobenzofuranone4,4'-[1(3H)-Oxoisobenzofuran-3-ylidene]bisanisole3,3-Bis(4-methoxyphenyl)-1,3-dihydroisobenzofuran-1-one4,4'-[3-Oxoisobenzofuran-1(3H)-ylidene]bis(1-methoxybenzene)
NSC-210211(3H)-Isobenzofuranone,3-bis(4-methoxyphenyl)-3,3-Bis(4-methoxyphenyl)-2-benzofuran-1(3H)-one3,3-Bis(4-methoxyphenyl)-2-benzofuran-1(3H)-one #
Database identifiers
- CAS
6315-80-6- PubChem CID
- 228259
- DTXSID
DTXSID10281262- Nikkaji
- J117.988H
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 464
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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