5-(3-Chlorophenyl)-6,8-dioxa-3-azabicyclo(3.2.1)octane (Z)-2-butenedioate (1:1)

Base Information

• Chemical Name: 5-(3-Chlorophenyl)-6,8-dioxa-3-azabicyclo(3.2.1)octane (Z)-2-butenedioate (1:1)
• CAS No.: 84508-98-5
• Molecular Formula: C15H16ClNO6
• Molecular Weight: 341.74

Synonyms:5-(3-Chlorophenyl)-6,8-dioxa-3-azabicyclo(3.2.1)octane (Z)-2-butenedioate (1:1);84508-98-5;6,8-Dioxa-3-azabicyclo(3.2.1)octane, 5-(3-chlorophenyl)-, (Z)-2-butenedioate (1:1);C11H12ClNO2.C4H4O4;C11-H12-Cl-N-O2.C4-H4-O4;LS-62133

Chemical Property of 5-(3-Chlorophenyl)-6,8-dioxa-3-azabicyclo(3.2.1)octane (Z)-2-butenedioate (1:1)

Chemical Property:

• Vapor Pressure: 4.59E-05mmHg at 25°C
• Boiling Point: 349.8°C at 760 mmHg
• Flash Point: 165.4°C
• PSA: 105.09000
• LogP: 1.55200
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 3
• Exact Mass: 341.0666149
• Heavy Atom Count: 23
• Complexity: 370

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: C1C2COC(O2)(CN1)C3=CC(=CC=C3)Cl.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: C1C2COC(O2)(CN1)C3=CC(=CC=C3)Cl.C(=C/C(=O)O)\C(=O)O

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