Alprazolam
Quantity
Unit
CAS #
28981-97-7
PRODUCT
SYNONYM
4H-[1,2,4]Triazolo[4,3-a][1,4]benzodiazepine, 8-chloro-1-methyl-6-phenyl-; 4H-s-Triazolo(4,3-a)(1,4)benzodiazepine, 8-chloro-1-methyl-6-phenyl-; 8-Chloro-1-methyl-6-phenyl-4H-s-triazolo(4,3-a)(1,4)benzodiazepine; D 65MT; U 31889; TUS-1; Xanax; Alplax; Taf
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FORMULA
C17H13ClN4
MOLECULAR WEIGHT
308.77
EINECS
249-349-2
SMILES
c12c(C(c3ccccc3)=NCc3n1c(nn3)C)cc(Cl)cc2
INCHI
1S/C17H13ClN4/c1-11-20-21-16-10-19-17(12-5-3-2-4-6-12)14-9-13(18)7-8-15(14)22(11)16/h2-9H,10H2,1H3
INCHIKEY
VREFGVBLTWBCJP-UHFFFAOYSA-N
VAPOR PRESSURE
1.65E-08 mm Hg
WATER SOLUBILITY
13.1 mg/L
ATMOSPHERIC OH RATE CONSTANT
7.62E-12 cm3/molecule-sec
HENRY'S LAW CONSTANT
9.77E-12 atm-m3/mole
LOG P (OCTANOL-WATER)
2.12
STORAGE TEMPERATURE
2-8°C
FLASH POINT
11 °C
SOLUBILITY
H2O: insoluble
MELTING POINT
228-228.50C
CLASS
Specialty Chemicals, Toxic Release Inventory (TRI) Chemicals
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