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Cas Database |
| Name |
N,N-Dimethylhistamine |
EINECS | N/A |
| CAS No. | 673-46-1 | Density | 1.038 g/cm3 |
| PSA | 31.92000 | LogP | 0.51380 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C7H13N3 | Boiling Point | 296 °C at 760 mmHg |
| Molecular Weight | 139.2 | Flash Point | 132.8 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
1H-Imidazole-4-ethanamine,N,N-dimethyl- (9CI);Imidazole, 4(or 5)-(2-dimethylaminoethyl)- (6CI);Imidazole, 4(or 5)-[2-(dimethylamino)ethyl]- (6CI,7CI);Imidazole,4-[2-(dimethylamino)ethyl]- (8CI);4-(2-Dimethylaminoethyl)imidazole;4-[2-(N,N-Dimethylamino)ethyl]imidazole;1H-Imidazole-5-ethanamine,N,N-dimethyl-;Na,Na-Dimethylhistamine;Nw,Nw-Dimethylhistamine;N',N'-Dimethylhistamine; |
Article Data | 8 |
N,N-Dimethylhistamine Chemical Properties
Molecule structure of N,N-Dimethylhistamine (CAS NO.673-46-1):
IUPAC Name: 2-(1H-Imidazol-5-yl)-N,N-dimethylethanamine
Molecular Weight: 139.19822 g/mol
Molecular Formula: C7H13N3
Density: 1.038 g/cm3
Boiling Point: 296 °C at 760 mmHg
Flash Point: 132.8 °C
Index of Refraction: 1.528
Molar Refractivity: 41.31 cm3
Molar Volume: 134 cm3
Surface Tension: 42.7 dyne/cm
Enthalpy of Vaporization: 53.58 kJ/mol
Vapour Pressure: 0.00147 mmHg at 25 °C
XLogP3: 0.3
H-Bond Donor: 1
H-Bond Acceptor: 2
Rotatable Bond Count: 3
Tautomer Count: 2
Exact Mass: 139.110947
MonoIsotopic Mass: 139.110947
Topological Polar Surface Area: 31.9
Heavy Atom Count: 10
Canonical SMILES: CN(C)CCC1=CN=CN1
InChI: InChI=1S/C7H13N3/c1-10(2)4-3-7-5-8-6-9-7/h5-6H,3-4H2,1-2H3,(H,8,9)
InChIKey: ZJDIMSMQXMWMCF-UHFFFAOYSA-N
Classification Code of N,N-Dimethylhistamine (CAS NO.673-46-1): Drug / Therapeutic Agent; Mutation data
N,N-Dimethylhistamine Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| guinea pig | LD50 | intraperitoneal | 15mg/kg (15mg/kg) | CARDIAC: OTHER CHANGES VASCULAR: MEASUREMENT OF REGIONAL BLOOD FLOW | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 87, Pg. 33, 1951. |
N,N-Dimethylhistamine Specification
N,N-Dimethylhistamine (CAS NO.673-46-1) is also named as 4-(2-Dimethylaminoethyl)imidazole ; N(sup alpha),N(sup alpha)-Dimethylhistamine ; SU-416 ; Imidazole, 4-(2-(dimethylamino)ethyl)- .
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