1-phenylbiguanide hydrochloride

structural formula

• numbering system
• physical property data
• toxicological data
• ecological data
• molecular structure data
• computing chemical data
• more
  • properties and stability
  • storage method
  • synthesis method
  • purpose

numbering system

cas number:55-57-2

mdl number:mfcd00035040

einecs number:200-239-2

rtecs number:du2550000

brn number:none

pubchem number:24898259

physical property data

none

toxicological data

1, acute toxicity: mice oral ld50: 1200mg/kg; mouse abdominal cavity ld50: 243mg/kg

ecological data

none

molecular structure data

5. molecular property data:

1. molar refractive index: 48.71

2. molar volume (m³/mol):132.5

3. isotonic specific volume (90.2k):369.4

4. surface tension (dyne/cm):60.2

5. polarizability（10^-24cm³):19.31

compute chemical data

1. reference value for hydrophobic parameter calculation (xlogp): none

2. number of hydrogen bond donors: 4

3. number of hydrogen bond acceptors: 1

4. number of rotatable chemical bonds: 2

5. number of tautomers: 5

6. topological molecule polar surface area 103

7. number of heavy atoms: 14

8. surface charge: 0

9. complexity: 211

10. number of isotope atoms: 0

11. determine the number of atomic stereocenters: 0

12. uncertain number of atomic stereocenters: 0

13. determine the number of chemical bond stereocenters: 0

14. number of uncertain chemical bond stereocenters: 0

15. number of covalent bond units: 2

properties and stability

none

storage method

none

synthesis method

none

purpose

none

extended-reading:https://www.morpholine.org/k-15-catalyst/
extended-reading:https://www.bdmaee.net/nt-cat-e-129-elastomer-catalyst-elastomer-catalyst-nt-cat-e-129/
extended-reading:https://www.bdmaee.net/wp-content/uploads/2022/08/129-4.jpg
extended-reading:https://www.newtopchem.com/archives/79
extended-reading:https://www.newtopchem.com/archives/811
extended-reading:https://www.newtopchem.com/archives/917
extended-reading:https://www.newtopchem.com/archives/44465
extended-reading:https://www.bdmaee.net/wp-content/uploads/2022/08/tributyltin-chloride-cas1461-22-9-tri-n-butyltin-chloride.pdf
extended-reading:https://www.bdmaee.net/wp-content/uploads/2022/08/130.jpg
extended-reading:https://www.bdmaee.net/nnnn-tetramethyl-16-hexanediamine/