2-(Hydroxyphenylmethyl)-1H-benzimidazole-5-acetic acid (Z)-2-butenedioate (1:1) (salt)

Base Information

• Chemical Name: 2-(Hydroxyphenylmethyl)-1H-benzimidazole-5-acetic acid (Z)-2-butenedioate (1:1) (salt)
• CAS No.: 62467-99-6
• Molecular Formula: C20H18N2O7
• Molecular Weight: 398.3661

Synonyms:2-(Hydroxyphenylmethyl)-1H-benzimidazole-5-acetic acid (Z)-2-butenedioate (1:1) (salt);62467-99-6;1H-Benzimidazole-5-acetic acid, 2-(hydroxyphenylmethyl)-, (Z)-2-butenedioate (1:1) (salt);{2-[Hydroxy(phenyl)methyl]-1H-benzimidazol-6-yl}acetic acid (2E)-2-butenedioate;C16H14N2O3.C4H4O4;LS-32592;C16-H14-N2-O3.C4-H4-O4

Chemical Property of 2-(Hydroxyphenylmethyl)-1H-benzimidazole-5-acetic acid (Z)-2-butenedioate (1:1) (salt)

Chemical Property:

• Vapor Pressure: 2.29E-16mmHg at 25°C
• Boiling Point: 622.7°C at 760 mmHg
• Flash Point: 330.4°C
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 6
• Exact Mass: 398.11140092
• Heavy Atom Count: 29
• Complexity: 490

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(C2=NC3=C(N2)C=C(C=C3)CC(=O)O)O.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: C1=CC=C(C=C1)C(C2=NC3=C(N2)C=C(C=C3)CC(=O)O)O.C(=C/C(=O)O)\C(=O)O

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