2-(4-Amidinophenyl)benzo(b)thiophene-6-carboxamidine

Base Information

• Chemical Name: 2-(4-Amidinophenyl)benzo(b)thiophene-6-carboxamidine
• CAS No.: 4816-14-2
• Molecular Formula: C16H14 N4 S
• Molecular Weight: 294.37
• DSSTox Substance ID: DTXSID60197445
• Nikkaji Number: J277.732K
• Wikidata: Q83070311
• ChEMBL ID: CHEMBL352923
• Mol file: 4816-14-2.mol

Synonyms:2-(4-amidinophenyl)benzo(b)thiophene-6-carboxamidine;DAPI-S

Chemical Property of 2-(4-Amidinophenyl)benzo(b)thiophene-6-carboxamidine

Chemical Property:

• Vapor Pressure: 6.3E-11mmHg at 25°C
• Boiling Point: 520.3°Cat760mmHg
• Flash Point: 268.5°C
• PSA: 127.98000
• Density: 1.42g/cm³
• LogP: 4.73650
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 294.09391764
• Heavy Atom Count: 21
• Complexity: 417

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1C2=CC3=C(S2)C=C(C=C3)C(=N)N)C(=N)N

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