1H-1,4-Benzodiazepine,2,3,4,5-tetrahydro-7-methyl- supplier

Name
7-METHYL-2,3,4,5-TETRAHYDRO-1H-BENZO[E][1,4]DIAZEPINE
EINECS
CAS No. 422318-36-3
Density 0.999 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₄N₂
Boiling Point 301 °C at 760 mmHg
Molecular Weight 162.11
Flash Point 181.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 7-METHYL-2,3,4,5-TETRAHYDRO-1H-BENZO[E][1,4]DIAZEPINE;1H-1,4-Benzodiazepine, 2,3,4,5-tetrahydro-7-methyl-
PSA 24.06000
LogP 1.97690

1H-1,4-Benzodiazepine,2,3,4,5-tetrahydro-7-methyl- Specification

The 1H-1,4-Benzodiazepine,2,3,4,5-tetrahydro-7-methyl-, with the CAS registry number 422318-36-3, is also known as 7-Methyl-2,3,4,5-tetrahydro-1H-. This chemical's molecular formula is C₁₀H₁₄N₂ and molecular weight is 162.23. Its IUPAC name is called 7-methyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine.

Physical properties of 1H-1,4-Benzodiazepine,2,3,4,5-tetrahydro-7-methyl-: (1)ACD/LogP: 1.19; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 3.79; (6)#H bond acceptors: 2; (7)#H bond donors: 2; (8)Index of Refraction: 1.527; (9)Molar Refractivity: 49.94 cm³; (10)Molar Volume: 162.3 cm³; (11)Surface Tension: 35.6 dyne/cm; (12)Density: 0.999 g/cm³; (13)Flash Point: 181.1 °C; (14)Enthalpy of Vaporization: 54.11 kJ/mol; (15)Boiling Point: 301 °C at 760 mmHg; (16)Vapour Pressure: 0.00108 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=CC2=C(C=C1)NCCNC2
(2)InChI: InChI=1S/C10H14N2/c1-8-2-3-10-9(6-8)7-11-4-5-12-10/h2-3,6,11-12H,4-5,7H2,1H3
(3)InChIKey: NJFPGSCEQVZTIQ-UHFFFAOYSA-N

Product Name

7-METHYL-2,3,4,5-TETRAHYDRO-1H-BENZO[E][1,4]DIAZEPINE

1H-1,4-Benzodiazepine,2,3,4,5-tetrahydro-7-methyl- Specification

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