
structural formula
| business number | 068f |
|---|---|
| molecular formula | c15h11cln2o2 |
| molecular weight | 286.71 |
| label |
7-chloro-2,3-dihydro-3-hydroxy-5-phenyl-1,4(2h)-benzodiazepine-2-one, 7-chloro-1,3-dihydro-3-hydroxy-5-phenyl-1,4(2h)-benzodiazepin-2-one |
numbering system
cas number:604-75-1
mdl number:mfcd00057903
einecs number:210-076-9
rtecs number:df1400000
brn number:none
pubchem number:24898014
physical property data
none yet
toxicological data
none yet
ecological data
3. ecological data:
1. other harmful effects: this substance may be harmful to the environment and should be harmful to water bodies. give special attention.
molecular structure data
5. molecular property data:
1, molar refractive index:76.43
2, molar volume (m3/mol):201.8
3, isotonic specific volume (90.2k ):548.8
4, surface tension (dyne/ cm):54.6
5、 polarizability (10-24cm3): 30.30
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): none
2. number of hydrogen bond donors: 2
3. number of hydrogen bond acceptors: 3
4. number of rotatable chemical bonds: 1
5. number of tautomers: 27
6. topological molecule polar surface area 61.7
7. number of heavy atoms: 20
8. surface charge: 0
9. complexity: 407
10. number of isotope atoms: 0
11. determine the number of atomic stereocenters: 0
12. uncertain number of atomic stereocenters: 1
13. determine the number of chemical bond stereocenters: 0
14. number of uncertain chemical bond stereocenters: 0
15. number of covalent bond units: 1
properties and stability
properties and stability:
no decomposition products may occur under normal temperatures and pressures.
storage method
1. storage
-20℃storage.
synthesis method
none yet
purpose
2. purpose
it has sedative, hypnotic, anti-anxiety, anti-epilepsy and muscle relaxation effects.

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