Methanone, [4-[[4-(2-benzoxazolyl)phenyl]methoxy]-2-hydroxyphenyl]phenyl-
Basic information
- CAS
52981-88-1- Standard SMILES
O=C(c1ccccc1)c1ccc(OCc2ccc(-c3nc4ccccc4o3)cc2)cc1O- InChIKey
ZKDCTCNNNKEFDY-UHFFFAOYSA-N- Molecular formula
- C27H19NO4
- Average molar mass
- 421.4 g/mol
- Monoisotopic mass
- 421.13140809
Names & identifiers
- Preferred name
- Methanone, [4-[[4-(2-benzoxazolyl)phenyl]methoxy]-2-hydroxyphenyl]phenyl-
- IUPAC
- [4-[[4-(1,3-benzoxazol-2-yl)phenyl]methoxy]-2-hydroxyphenyl]-phenylmethanone
- English name
- [4-[[4-(Benzoxazol-2-yl)phenyl]methoxy]-2-hydroxyphenyl]phenylmethanone
- Molecular formula
- C27H19NO4
- Molecular weight
- 421.44
Names & synonyms
Methanone, [4-[[4-(2-benzoxazolyl)phenyl]methoxy]-2-hydroxyphenyl]phenyl-2-(alpha-(4-Benzoyl-3-hydroxyphenoxy)-p-tolyl)benzoxazoleDTXSID4068820Methanone, (4-((4-(2-benzoxazolyl)phenyl)methoxy)-2-hydroxyphenyl)phenyl-RefChem:811699DTXCID204133352981-88-1SCHEMBL11844094ZKDCTCNNNKEFDY-UHFFFAOYSA-NDB-290461[4-[[4-(Benzoxazol-2-yl)phenyl ]methoxy]-2-hydroxyphenyl ]phenylmethanone(4-{[4-(1,3-Benzoxazol-2-yl)phenyl]methoxy}-2-hydroxyphenyl)(phenyl)methanone
Show more names
[4-[[4-(Benzoxazol-2-yl)phenyl]methoxy]-2-hydroxyphenyl]phenylmethanone
Database identifiers
- CAS
52981-88-1- PubChem CID
- 104375
- DTXSID
DTXSID4068820- Nikkaji
- J429.201D
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 72.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 613
Physicochemical properties
- EPA Substance Registry System
- 4 · Methanone, [4-[[4-(2-benzoxazolyl)phenyl]methoxy]-2-hydroxyphenyl]phenyl- (52981-88-1)
- TSCA
- TSCA listed
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
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationMethanone, [4-[[4-(2-benzoxazolyl)phenyl]methoxy]-2-hydroxyphenyl]phenyl-: INACTIVE
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Related reactions
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Compound notes
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