Methanone, (4-nitrophenyl)(4-(alpha-D-xylopyranosyloxy)phenyl)-

Base Information

• Chemical Name: Methanone, (4-nitrophenyl)(4-(alpha-D-xylopyranosyloxy)phenyl)-
• CAS No.: 147029-72-9
• Molecular Formula: C18H17 N O8
• Molecular Weight: 375.3295
• DSSTox Substance ID: DTXSID00163568
• Nikkaji Number: J571.355B
• Wikidata: Q83032495
• ChEMBL ID: CHEMBL366777

Synonyms:Methanone, (4-nitrophenyl)(4-(alpha-D-xylopyranosyloxy)phenyl)-;(4-Nitrophenyl)(4-(alpha-D-xylopyranosyloxy)phenyl)methanone;147029-72-9;CHEMBL366777;SCHEMBL11027405;DTXSID00163568;LS-91318;4-[4-Nitrobenzoyl]phenyl alpha-D-xylopyranoside

Chemical Property of Methanone, (4-nitrophenyl)(4-(alpha-D-xylopyranosyloxy)phenyl)-

Chemical Property:

• Vapor Pressure: 2.57E-17mmHg at 25°C
• Boiling Point: 641.2°C at 760 mmHg
• Flash Point: 341.6°C
• Density: 1.514g/cm³
• XLogP3: 1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 4
• Exact Mass: 375.09541650
• Heavy Atom Count: 27
• Complexity: 522

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MSDS Files:

Useful:

• Canonical SMILES: C1C(C(C(C(O1)OC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])O)O)O
• Isomeric SMILES: C1[C@H]([C@@H]([C@H]([C@H](O1)OC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])O)O)O

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