CID 11461514
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Basic information
- CAS
153151-22-5- Standard SMILES
CCC1=C/C(=C2\ONC=C2c2ccc(OC)cc2)C(=O)C=C1OC- InChIKey
REUNIRRMGNFOCY-XDJHFCHBSA-N- Molecular formula
- C19H19NO4
- Average molar mass
- 325.4 g/mol
- Monoisotopic mass
- 325.13140809
Names & identifiers
- Preferred name
- CID 11461514
- IUPAC
- (6E)-4-ethyl-3-methoxy-6-[4-(4-methoxyphenyl)-2H-1,2-oxazol-5-ylidene]cyclohexa-2,4-dien-1-one
- English name
- Copper(II)-2,3,9,10,16,17,23,24-octa-n-hexyl-29H,31H-phthalocyanine
- Molecular formula
- C19H19NO4
- Molecular weight
- 325.35846
Names & synonyms
CUPC-8HCopper(II)-2,3,9,10,16,17,23,24-octa-n-hexyl-29H,31H-phthalocyanine
Database identifiers
- CAS
153151-22-5- PubChem CID
- 11461514
Properties
Computed structural propertiesFilling in
- XLogP
- 2.9
- Topological polar surface area
- 56.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 634
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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