Melting point: |
181-186 °C |
Boiling point: |
390.5±52.0 °C(Predicted) |
Density |
1.68±0.1 g/cm3(Predicted) |
storage temp. |
2-8°C |
solubility |
Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly) |
form |
Solid |
pka |
-15.63±0.60(Predicted) |
color |
White to Off-White |
optical activity |
[α]20/D +89±3°, c = 0.5% in chloroform |
BRN |
3653352 |
InChI |
InChI=1/C10H13Cl2NO3S/c1-7(2)6-3-4-8(7)5-17(14,15)13-10(8,16-13)9(6,11)12/h6H,3-5H2,1-2H3/t6-,8-,10+,13?/s3 |
InChIKey |
HAMBQYFZDBYWHU-XCDSEQPNNA-N |
SMILES |
[C@@]123ON1S(=O)(=O)C[C@@]12CC[C@@]([H])(C1(C)C)C3(Cl)Cl |&1:0,7,10,r| |