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Cas Database |
| Name |
(+)-Carlumine |
EINECS | N/A |
| CAS No. | 485-51-8 | Density | 1.339g/cm3 |
| PSA | 66.46000 | LogP | 2.81110 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C21H21NO6 | Boiling Point | 542.1°Cat760mmHg |
| Molecular Weight | 383.43 | Flash Point | 281.6°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | A poison by intraperitoneal route. When heated to decomposition it emits toxic vapors of NOx. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | A poison. |
| Synonyms |
N/A |
Article Data | 9 |
(+)-Carlumine Chemical Properties
Molecular Structure of (+)-Carlumine (CAS NO. 485-51-8):
.jpg)
IUPAC Name: 6-(6,7-Dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)-6H-furo[3,4-g][1,3]benzodioxol-8-one
Molecular Formula: C21H21NO6
Molecular Weight: 383.394540 g/mol
XLogP3-AA: 2.7
H-Bond Donor: 0
H-Bond Acceptor: 7
Canonical SMILES: CN1CCC2=CC(=C(C=C2C1C3C4=C(C5=C(C=C4)OCO5)C(=O)O3)OC)OC
InChI: InChI=1S/C21H21NO6/c1-22-7-6-11-8-15(24-2)16(25-3)9-13(11)18(22)19-12-4-5-14-20(27-10-26-14)17(12)21(23)28-19/h4-5,8-9,18-19H,6-7,10H2,1-3H3
InChIKey: SZDGAZFTAUFFQH-UHFFFAOYSA-N
Index of Refraction: 1.614
Molar Refractivity: 99.81 cm3
Molar Volume: 286.2 cm3
Surface Tension: 51.8 dyne/cm
Density: 1.339 g/cm3
Flash Point: 281.6 °C
Enthalpy of Vaporization: 82.01 kJ/mol
Boiling Point: 542.1 °C at 760 mmHg
Vapour Pressure of (+)-Carlumine (CAS NO. 485-51-8): 8.17E-12 mmHg at 25 °C
(+)-Carlumine Toxicity Data With Reference
| 1. | ipr-rat LDLo:25 mg/kg | NCNSA6 National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. 5 (1953),30. |
(+)-Carlumine Safety Profile
A poison by intraperitoneal route. When heated to decomposition it emits toxic vapors of NOx.
(+)-Carlumine Specification
(+)-Carlumine with cas registry number of 485-51-8 is also named as Corlumine ; NSC 32983 ; Corlumine (8CI) ; Furo(3,4-e)-1,3-benzodioxol-8(6H)-one, 6-(1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl)-, (R-(R*,S*))- .
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