175712-02-4

Name 4-Chloro-benzenesulfonic acid 5-(2,4-difluoro-phenyl)-5-[1,2,4]triazol-1-ylMethyl-tetrahydro-furan-3-ylMethyl ester
CAS 175712-02-4
EINECS(EC#) 605-760-2
Molecular Formula C20H18ClF2N3O4S
MDL Number MFCD28009665
Molecular Weight 469.889
MOL File 175712-02-4.mol

Chemical Properties

Boiling point  612.9±65.0 °C(Predicted)
density  1.49±0.1 g/cm3(Predicted)
storage temp.  Sealed in dry,Room Temperature
pka 2.75±0.10(Predicted)
Appearance White to off-white Solid
InChI InChI=1S/C20H18ClF2N3O4S/c21-15-1-4-17(5-2-15)31(27,28)30-10-14-8-20(29-9-14,11-26-13-24-12-25-26)18-6-3-16(22)7-19(18)23/h1-7,12-14H,8-11H2/t14-,20-/m0/s1
InChIKey WUPORSBDFSRGHD-XOBRGWDASA-N
SMILES C1(S(OC[C@H]2C[C@](CN3C=NC=N3)(C3=CC=C(F)C=C3F)OC2)(=O)=O)=CC=C(Cl)C=C1
CAS DataBase Reference 175712-02-4

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P305+P351+P338

Hazard Information

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