1-(Benzylideneamino)-3-nitroguanidine
TL;DR: 1-(Benzylideneamino)-3-nitroguanidine (CAS 5347-90-0) is a chemical compound with molecular formula C8H9N5O2 and molecular weight 207.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(E)-benzylideneamino]-1-nitroguanidine
Also Known As: 1-(BENZYLIDENEAMINO)-3-NITROGUANIDINE, 2-[(E)-benzylideneamino]-1-nitroguanidine, BAS 00253375
| Molecular Formula | C8H9N5O2 |
|---|---|
| Molecular Weight | 207.08 g/mol |
| LogP | 0.1165 |
| Topological Polar Surface Area | 105.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 207.07562 |
| Heavy Atoms | 15 |
| Complexity | 387.27832 |
Chemical Identifiers
| CAS Number | 5347-90-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=N/N=C(/N)\N[N+](=O)[O-] |
Product Overview
1-(Benzylideneamino)-3-nitroguanidine (CAS 5347-90-0), with molecular formula C8H9N5O2 and molecular weight 207.08 g/mol. IUPAC: 2-[(E)-benzylideneamino]-1-nitroguanidine.
Chemical Property Profile of 1-(Benzylideneamino)-3-nitroguanidine
Property Insights of 1-(Benzylideneamino)-3-nitroguanidine
The XLogP value of 0.1165 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Benzylideneamino)-3-nitroguanidine. The TPSA of 105.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Benzylideneamino)-3-nitroguanidine. Following Lipinski's Rule of Five, 1-(Benzylideneamino)-3-nitroguanidine has 2 hydrogen bond donor(s) and 4 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 1-(Benzylideneamino)-3-nitroguanidine?
The CAS number of 1-(Benzylideneamino)-3-nitroguanidine is 5347-90-0.
What is the molecular formula of 1-(Benzylideneamino)-3-nitroguanidine?
The molecular formula of 1-(Benzylideneamino)-3-nitroguanidine is C8H9N5O2.
What is the molecular weight of 1-(Benzylideneamino)-3-nitroguanidine?
The molecular weight of 1-(Benzylideneamino)-3-nitroguanidine is 207.08 g/mol.
Where can I buy 1-(Benzylideneamino)-3-nitroguanidine?
You can request a quote for 1-(Benzylideneamino)-3-nitroguanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Benzylideneamino)-3-nitroguanidine?
Yes, KEHONG BIO provides custom synthesis services for 1-(Benzylideneamino)-3-nitroguanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.