2H-Indazole-3-carbaldehyde supplier

Name
2H-Indazole-3-carboxaldehyde (7CI)
EINECS
CAS No. 89939-16-2
Density 1.369 g/cm³
Solubility
Melting Point
Formula C₈H₆N₂O
Boiling Point 193.585 °C at 760 mmHg
Molecular Weight 146.15
Flash Point 71.519 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2H-Indazole-3-carboxaldehyde (7CI);
PSA 45.75000
LogP 1.37540

2H-Indazole-3-carbaldehyde Specification

2H-Indazole-3-carbaldehyde, with the CAS registry number 89939-16-2, is also named as 2H-Indazole-3-carboxaldehyde. This chemical's molecular formula is C₈H₆N₂O and molecular weight is 146.15. What's more, its systematic name is 2H-Indazole-3-carbaldehyde.

Physical properties of 2H-Indazole-3-carbaldehyde are: (1)ACD/LogP: 1.111; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.11; (4)ACD/LogD (pH 7.4): 1.11; (5)ACD/BCF (pH 5.5): 4.11; (6)ACD/BCF (pH 7.4): 4.11; (7)ACD/KOC (pH 5.5): 95.80; (8)ACD/KOC (pH 7.4): 95.79; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 45.75 Å²; (13)Index of Refraction: 1.747; (14)Molar Refractivity: 43.373 cm³; (15)Molar Volume: 106.761 cm³; (16)Polarizability: 17.194×10^-24cm³; (17)Surface Tension: 71.01 dyne/cm; (18)Density: 1.369 g/cm³; (19)Flash Point: 71.519 °C; (20)Enthalpy of Vaporization: 42.978 kJ/mol; (21)Boiling Point: 193.585 °C at 760 mmHg; (22)Vapour Pressure: 0.5 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc1c2ccccc2nn1
(2)Std. InChI: InChI=1S/C8H6N2O/c11-5-8-6-3-1-2-4-7(6)9-10-8/h1-5H,(H,9,10)
(3)Std. InChIKey: VXOSGHMXAYBBBB-UHFFFAOYSA-N

Product Name

2H-Indazole-3-carboxaldehyde (7CI)

2H-Indazole-3-carbaldehyde Specification

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