Basic information
- CAS
23743-30-8- Standard SMILES
COC(=O)c1ccc2oc(-c3ccc(-c4nc5cc(C(=O)OC)ccc5o4)c4ccccc34)nc2c1- InChIKey
GHSQUTFRTKIVBU-UHFFFAOYSA-N- Molecular formula
- C28H18N2O6
- Average molar mass
- 478.5 g/mol
- Monoisotopic mass
- 478.1164863
Names & identifiers
- Preferred name
- 5-Benzoxazolecarboxylic acid, 2,2'-(1,4-naphthalenediyl)bis-, 5,5'-dimethyl ester
- IUPAC
- methyl 2-[4-(5-methoxycarbonyl-1,3-benzoxazol-2-yl)naphthalen-1-yl]-1,3-benzoxazole-5-carboxylate
- English name
- dimethyl 2,2'-(naphthalene-1,4-diyl)bis(benzoxazole-5-carboxylate)
- Molecular formula
- C28H18N2O6
- Molecular weight
- 478.45
Names & synonyms
EINECS 245-858-95-Benzoxazolecarboxylic acid, 2,2'-(1,4-naphthalenediyl)bis-, 5,5'-dimethyl esterRefChem:53253823743-30-85-Benzoxazolecarboxylic acid, 2,2'-(1,4-naphthalenediyl)bis-, dimethyl esterDimethyl 2,2'-(naphthalene-1,4-diyl)bis(benzo[d]oxazole-5-carboxylate)5,5'-Dimethyl 2,2'-(1,4-naphthalenediyl)bis[5-benzoxazolecarboxylate]Dimethyl 2,2'-(naphthalene-1,4-diyl)di(1,3-benzoxazole-5-carboxylate)METHYL 2-{4-[5-(METHOXYCARBONYL)-1,3-BENZOXAZOL-2-YL]NAPHTHALEN-1-YL}-1,3-BENZOXAZOLE-5-CARBOXYLATEDimethyl 2,2'-(naphthalene-1,4-diyl)bis(benzoxazole-5-carboxylate)dimethyl 2,2'-naphthalene-1,4-diylbis(1,3-benzoxazole-5-carboxylate)Oprea1_017927
Show more names
2,2'-(1,4-Naphthalenediyl)bis(5-benzoxazolecarboxylic acid)dimethyl ester
Oprea1_622435CBDivE_00818698J8HT8GW2CHEMBL5000467DTXSID8066927GHSQUTFRTKIVBU-UHFFFAOYSA-NSTK764130AKOS000513795
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 758
Physicochemical properties
- EPA Substance Registry System
- 5 · 5-Benzoxazolecarboxylic acid, 2,2'-(1,4-naphthalenediyl)bis-, dimethyl ester (23743-30-8)
- 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 Information5-Benzoxazolecarboxylic acid, 2,2'-(1,4-naphthalenediyl)bis-, 5,5'-dimethyl ester: INACTIVE
Suppliers1 total
南京新瑞医药科技有限公司19850079587 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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