Chemical Properties of 6«beta»-Hydroxyhyoscyamine (CAS 52646-91-0)

6«beta»-Hydroxyhyoscyamine

PDF Excel Molecule Calculator
InChI
InChI=1S/C17H23NO4/c1-18-12-7-13(9-15(18)16(20)8-12)22-17(21)14(10-19)11-5-3-2-4-6-11/h2-6,12-16,19-20H,7-10H2,1H3/t12?,13-,14?,15?,16-/m1/s1
InChI Key
WTQYWNWRJNXDEG-BLJPBYAASA-N
Formula
C17H23NO4
SMILES
CN1C2CC(OC(=O)C(CO)c3ccccc3)CC1C(O)C2
Molecular Weight1
305.37
CAS
52646-91-0
Other Names
  • 6-Hydroxyhyoscyamine
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
log10WS -2.20 Crippen Calculated Property
logPoct/wat 0.902 Crippen Calculated Property
McVol 234.070 ml/mol McGowan Calculated Property
Inp [2308.00; 2355.00]   Show Hide
Inp 2308.00 NIST
Inp 2355.00 NIST

Similar Compounds

Tropic acid, 6-hydroxy-3-tropanyl ester. 3-Hydroxy-2-phenyl-propionic acid 6-hydroxy-8-methyl-8-aza-bicyclo[3.2.1]oct-3-yl ester. Aposcopolamine. Methylscopolamine. Scopolamine. 6-(2-Methylbutyryloxy)-hyoscyamine. 6-Tigloyloxyhyoscyamine. Norscopolamine. 3-Tropoyloxy-6-acetoxytropane. Aponorscopolamine. 6-Hydroxylittorine. 3-(2'-Hydroxytropoyloxy)-6,7-epoxytropane. Thymidine, 3'-O-TMS, 5'-O-cyclotetramethylene-tertbutylsilyl. Thymidine, 3'-O-TMS, 5'-O-cyclotetramethylene-isopropylsilyl. Thymidine, 3',5'-bis(O-TMTBSi).

Find more compounds similar to 6«beta»-Hydroxyhyoscyamine.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.