Chemical Properties of Aposcopolamine

Aposcopolamine

PDF Excel Molecule Calculator
InChI
InChI=1S/C17H21NO4/c1-18-13-7-11(8-14(18)16-15(13)22-16)21-17(20)12(9-19)10-5-3-2-4-6-10/h2-6,11-16,19H,7-9H2,1H3/t11?,12?,13-,14+,15-,16+
InChI Key
STECJAGHUSJQJN-QBMZJCKTSA-N
Formula
C17H21NO4
SMILES
CN1C2CC(OC(=O)C(CO)c3ccccc3)CC1C1OC12
Molecular Weight1
303.35
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 -2.03 Crippen Calculated Property
logPoct/wat 0.918 Crippen Calculated Property
McVol 223.210 ml/mol McGowan Calculated Property
Inp [2130.00; 2130.00]   Show Hide
Inp 2130.00 NIST
Inp 2130.00 NIST
Inp 2130.00 NIST

Similar Compounds

Scopolamine. Methylscopolamine. 3-(2'-Hydroxytropoyloxy)-6,7-epoxytropane. 6-Tigloyloxyhyoscyamine. Aponorscopolamine. Norscopolamine. 3-Hydroxy-2-phenyl-propionic acid 6-hydroxy-8-methyl-8-aza-bicyclo[3.2.1]oct-3-yl ester. 6«beta»-Hydroxyhyoscyamine. Tropic acid, 6-hydroxy-3-tropanyl ester. 6-(2-Methylbutyryloxy)-hyoscyamine. 3-Tropoyloxy-6-acetoxytropane. Tropate, TMS. Benzeneacetic acid, «alpha»-[[(trimethylsilyl)oxy]methyl]-, 9-methyl-3-oxa-9-azatricyclo[3.3.1.0(2,4)]non-7-yl ester, [7(S)-(1«alpha»,2«beta»,4«beta»,5«alpha»,7«beta»)]-. Thymidine, 3'-O-TFA, 5'-O-cyclotetramethylene-isopropylsilyl. Thymidine, 3',5'-bis(O-TMTBSi).

Find more compounds similar to Aposcopolamine.

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.