CAS
93940-71-7 Purity
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93940-71-7 Purity
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3-(5-Nitro-1H-benzimidazol-2-yl)benzonitrile
CAS
939408-92-1
Catalog Number
ACM939408921
Category
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- Synthetic Use
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What is the molecular formula of 3-(5-nitro-1H-benzimidazol-2-yl)benzonitrile?
The molecular formula is C14H8N4O2.
What is the PubChem CID of 3-(5-nitro-1H-benzimidazol-2-yl)benzonitrile?
The PubChem CID is 90478078.
What is the molecular weight of 3-(5-nitro-1H-benzimidazol-2-yl)benzonitrile?
The molecular weight is 264.24 g/mol.
What is the IUPAC name of 3-(5-nitro-1H-benzimidazol-2-yl)benzonitrile?
The IUPAC name is 3-(6-nitro-1H-benzimidazol-2-yl)benzonitrile.
What is the InChI of 3-(5-nitro-1H-benzimidazol-2-yl)benzonitrile?
The InChI is InChI=1S/C14H8N4O2/c15-8-9-2-1-3-10(6-9)14-16-12-5-4-11(18(19)20)7-13(12)17-14/h1-7H,(H,16,17).
What is the InChIKey of 3-(5-nitro-1H-benzimidazol-2-yl)benzonitrile?
The InChIKey is CPCOXRBHFLZTGH-UHFFFAOYSA-N.
What is the Canonical SMILES of 3-(5-nitro-1H-benzimidazol-2-yl)benzonitrile?
The Canonical SMILES is C1=CC(=CC(=C1)C2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-])C#N.
What is the XLogP3 value of 3-(5-nitro-1H-benzimidazol-2-yl)benzonitrile?
The XLogP3 value is 3.1.
How many hydrogen bond donors are there in 3-(5-nitro-1H-benzimidazol-2-yl)benzonitrile?
There is 1 hydrogen bond donor.
How many hydrogen bond acceptors are there in 3-(5-nitro-1H-benzimidazol-2-yl)benzonitrile?
There are 4 hydrogen bond acceptors.
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