Benzylthiourea

• Catalog Number: ACM621830
• Product Name: Benzylthiourea
• CAS: 621-83-0
• Category: Heterocyclic Organic Compound
• IUPAC Name: benzylthiourea
• Molecular Weight: 166.25g/mol
• Molecular Formula: C8H10N2S
• Canonical SMILES: C1=CC=C(C=C1)CNC(=S)N
• InChI: InChI=1S/C8H10N2S/c9-8(11)10-6-7-4-2-1-3-5-7/h1-5H,6H2,(H3,9,10,11)
• InChI Key: UCGFRIAOVLXVKL-UHFFFAOYSA-N
• Complexity: 130
• Covalently-Bonded Unit Count: 1
• EC Number: 210-709-9
• Exact Mass: 166.05647g/mol
• Formal Charge: 0
• H-Bond Acceptor: 1
• H-Bond Donor: 2
• Heavy Atom Count: 11
• Monoisotopic Mass: 166.05647g/mol
• NSC Number: 15510
• Rotatable Bond Count: 2
• UNII: MRP6Y7412K
• XLogP3: 1.3