Chemical Properties of bromazepam-N(Py)-oxide

bromazepam-N(Py)-oxide

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InChI
InChI=1S/C14H10BrN3O2/c15-9-4-5-11-10(7-9)14(16-8-13(19)17-11)12-3-1-2-6-18(12)20/h1-7H,8H2,(H,17,19)
InChI Key
UXBHJGIEDLZVCU-UHFFFAOYSA-N
Formula
C14H10BrN3O2
SMILES
O=C1CN=C(c2cccc[n+]2[O-])c2cc(Br)ccc2N1
Molecular Weight1
332.15
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Physical Properties

Property Value Unit Source
ω 0.6597 Relay (1.0) Calculated Property
ΔfG° 293.92 kJ/mol Relay (1.0-beta) Calculated Property ⚠️
ΔfH°gas 206.56 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 114.22 kJ/mol Relay (1.0) Calculated Property
IE 7.67 eV Relay (1.0) Calculated Property
log10WS -3.46 Relay (1.0) Calculated Property
logPoct/wat 1.872 Crippen Calculated Property
McVol 200.320 ml/mol McGowan Calculated Property
Pc 3825.01 kPa Relay (1.0-beta) Calculated Property ⚠️
Inp 2650.00 NIST
Tboil 689.53 K Relay (1.0) Calculated Property
Tc 1049.37 K Relay (1.0) Calculated Property
Tfus 529.68 K Relay (1.0) Calculated Property
Vc 0.667 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Bromazepam. Bromazepam-3-hydroxy. 3-O,6-O,N-Triacetylnormorphine. Benzylmorphine. Nicocodine. Buprenorphine. 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 bromazepam-N(Py)-oxide.

Sources

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