Benzaldehyde semicarbazone
TL;DR: Benzaldehyde semicarbazone (CAS 1600-61-9) is a chemical compound with molecular formula C8H9N3O and molecular weight 163.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-benzylideneamino]urea
Also Known As: Benzaldehyde semicarbazone, Benzylidenesemicarbazide, 1-Benzylidenesemicarbazide, BS compound, 2-benzylidenehydrazinecarboxamide
| Molecular Formula | C8H9N3O |
|---|---|
| Molecular Weight | 163.07 g/mol |
| LogP | 0.6888 |
| Topological Polar Surface Area | 67.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 163.07455 |
| Heavy Atoms | 12 |
| Complexity | 281.61426 |
Chemical Identifiers
| CAS Number | 1600-61-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=N/NC(=O)N |
Product Overview
Benzaldehyde semicarbazone (CAS 1600-61-9), with molecular formula C8H9N3O and molecular weight 163.07 g/mol. IUPAC: [(E)-benzylideneamino]urea.
Chemical Property Profile of Benzaldehyde semicarbazone
Property Insights of Benzaldehyde semicarbazone
The XLogP value of 0.6888 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzaldehyde semicarbazone. The TPSA of 67.48 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzaldehyde semicarbazone. Following Lipinski's Rule of Five, Benzaldehyde semicarbazone has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzaldehyde semicarbazone?
The CAS number of Benzaldehyde semicarbazone is 1600-61-9.
What is the molecular formula of Benzaldehyde semicarbazone?
The molecular formula of Benzaldehyde semicarbazone is C8H9N3O.
What is the molecular weight of Benzaldehyde semicarbazone?
The molecular weight of Benzaldehyde semicarbazone is 163.07 g/mol.
Where can I buy Benzaldehyde semicarbazone?
You can request a quote for Benzaldehyde semicarbazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzaldehyde semicarbazone?
Yes, KEHONG BIO provides custom synthesis services for Benzaldehyde semicarbazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.