1H-Indazole,4-iodo-1-methyl- supplier

Name
1H-INDAZOLE, 4-IODO-1-METHYL-
EINECS
CAS No. 935661-15-7
Density 1.892 g/cm³
Solubility
Melting Point
Formula C₈H₇IN₂
Boiling Point 318.45 °C at 760 mmHg
Molecular Weight 258.061
Flash Point 146.393 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-iodo-1-methyl-indazole;935661-15-7;
PSA 17.82000
LogP 2.17790

1H-Indazole,4-iodo-1-methyl- Specification

The 1H-Indazole,4-iodo-1-methyl- has the CAS registry number 935661-15-7. This chemical's molecular formula is C₈H₇IN₂ and molecular weight is 258.06. What's more, its systematic name is 4-iodo-1-methyl-indazole.

Physical properties of 1H-Indazole,4-iodo-1-methyl- are: (1)ACD/LogP: 3.07; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.073; (4)ACD/LogD (pH 7.4): 3.073; (5)ACD/BCF (pH 5.5): 127.431; (6)ACD/BCF (pH 7.4): 127.432; (7)ACD/KOC (pH 5.5): 1118.319; (8)ACD/KOC (pH 7.4): 1118.324; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 17.82 Å²; (13)Index of Refraction: 1.718; (14)Molar Refractivity: 53.79 cm³; (15)Molar Volume: 136.428 cm³; (16)Polarizability: 21.324×10^-24 cm³; (17)Surface Tension: 49.973 dyne/cm; (18)Density: 1.892 g/cm³; (19)Flash Point: 146.393 °C; (20)Enthalpy of Vaporization: 53.766 kJ/mol; (21)Boiling Point: 318.45 °C at 760 mmHg; (22)Vapour Pressure: 0.001 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: Cn1c2cccc(c2cn1)I
(2)InChI: InChI=1/C8H7IN2/c1-11-8-4-2-3-7(9)6(8)5-10-11/h2-5H,1H3
(3)InChIKey: UAOIHDMXVVPOAZ-UHFFFAOYAU

Product Name

1H-INDAZOLE, 4-IODO-1-METHYL-

1H-Indazole,4-iodo-1-methyl- Specification

Related Products

Hot Products