Chemical Properties of propyl-«delta»1-tetrahydrocannabinolic acid, n-butyl-boronate

propyl-«delta»1-tetrahydrocannabinolic acid, n-butyl-boronate

InChI
InChI=1S/C24H33BO4/c1-6-8-12-25-28-22-20(23(26)29-25)16(9-7-2)14-19-21(22)17-13-15(3)10-11-18(17)24(4,5)27-19/h13-14,17-18H,6-12H2,1-5H3
InChI Key
WILKJDZOTASJBN-UHFFFAOYSA-N
Formula
C24H33BO4
SMILES
CCCCB1OC(=O)c2c(CCC)cc3c(c2O1)C1C=C(C)CCC1C(C)(C)O3
Molecular Weight1
396.33
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Physical Properties

Property Value Unit Source
ω 0.8583 Relay (1.0) Calculated Property
ΔfG° -285.61 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -786.72 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 114.92 kJ/mol Relay (1.0) Calculated Property
IE 7.92 eV Relay (1.0) Calculated Property
log10WS -6.46 Relay (1.0) Calculated Property
logPoct/wat 6.088 Crippen Calculated Property
Pc 640.91 kPa Relay (1.0-beta) Calculated Property
Inp [2812.00; 2812.00]   Show Hide
Inp 2812.00 NIST
Inp 2812.00 NIST
Tboil 718.02 K Relay (1.0) Calculated Property
Tc 971.52 K Relay (1.0) Calculated Property
Tfus 385.41 K Relay (1.0) Calculated Property
Vc 1.193 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

«delta»1-tetrahydrocannabinolic acid, n-butyl-boronate. «delta»1-tetrahydrocannabinolic acid, methyl-boronate. propyl-«delta»1-tetrahydrocannabinolic acid, methyl-boronate. «delta»1-tetrahydrocannabinolic acid, phenyl-boronate. Ergotaman-3',6',18-trione, 12'-hydroxy-2'-(1-methylethyl)-5'-(2-methylpropyl)-, (5'«alpha»)-. AJMALINE, M(DIHYDRO-), AC. Dihydroergokryptine. Crinan-11-ol, 1,2-didehydro-3-methoxy-, (3«beta»,5«alpha»,11R,13«beta»,19«alpha»)-. [2,2'-Bimorphinan]-3,3',6,6'-tetrol, 7,7',8,8'-tetradehydro-4,5:4',5'-diepoxy-17,17'-dimethyl-, (5«alpha»,6«alpha»)-(5'«alpha»,6'«alpha»)-. Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester). Triazolo[4,5-d]pyrimidin-7-ol,3h-v-, 5-amino-3-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-, 5'-diphenyl phosphate (keto form). Deserpidine. Paclitaxel. Ergotaman-3',6',18-trione, 9,10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'«alpha»,10«alpha»)-. Ergotamine.

Find more compounds similar to propyl-«delta»1-tetrahydrocannabinolic acid, n-butyl-boronate.

Sources

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