1-Hydroxy-5-(isobutoxycarbonylamino)-2-naphthoic acid phenyl ester

Base Information

• Chemical Name: 1-Hydroxy-5-(isobutoxycarbonylamino)-2-naphthoic acid phenyl ester
• CAS No.: 111130-87-1
• Molecular Formula: C22H21NO5
• Molecular Weight: 379.41
• DSSTox Substance ID: DTXSID80457437
• Nikkaji Number: J93.734G
• Wikidata: Q82280281
• Mol file: 111130-87-1.mol

Synonyms:111130-87-1;AGN-PC-0NGYHW;SCHEMBL8154353;DTXSID80457437;1-Hydroxy-5-(isobutoxycarbonylamino)-2-naphthoic acid phenyl ester

Chemical Property of 1-Hydroxy-5-(isobutoxycarbonylamino)-2-naphthoic acid phenyl ester

Chemical Property:

• PSA: 88.35000
• LogP: 4.98270
• XLogP3: 5.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 7
• Exact Mass: 379.14197277
• Heavy Atom Count: 28
• Complexity: 531

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)COC(=O)NC1=CC=CC2=C1C=CC(=C2O)C(=O)OC3=CC=CC=C3

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