1H-Pyrazole-4-carboxylicacid, 1-(3,5-dichlorophenyl)-5-propyl- supplier

Name
1-(3,5-DICHLOROPHENYL)-5-PROPYL-1H-PYRAZOLE-4-CARBOXYLIC ACID
EINECS
CAS No. 306936-60-7
Density 1.4 g/cm³
Solubility
Melting Point 169 °C
Formula C₁₃H₁₂Cl₂N₂O₂
Boiling Point 457.6 °C at 760 mmHg
Molecular Weight 299.156
Flash Point 230.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-(3,5-Dichlorophenyl)-5-propyl-1H-pyrazole-4-carboxylicacid;
PSA 55.12000
LogP 3.82980

1H-Pyrazole-4-carboxylicacid, 1-(3,5-dichlorophenyl)-5-propyl- Specification

The CAS registry number of 1H-Pyrazole-4-carboxylicacid, 1-(3,5-dichlorophenyl)-5-propyl- is 306936-60-7. This chemical's molecular formula is C₁₃H₁₂Cl₂N₂O₂ and molecular weight is 299.15. Its IUPAC name is called 1-(3,5-dichlorophenyl)-5-propyl-1H-pyrazole-4-carboxylic acid.

Physical properties of 1H-Pyrazole-4-carboxylicacid, 1-(3,5-dichlorophenyl)-5-propyl-: (1)ACD/LogP: 4.52; (2)ACD/LogD (pH 5.5): 2.64; (3)ACD/LogD (pH 7.4): 1.46; (4)ACD/BCF (pH 5.5): 21.29; (5)ACD/BCF (pH 7.4): 1.39; (6)ACD/KOC (pH 5.5): 91.08; (7)ACD/KOC (pH 7.4): 5.93; (8)#H bond acceptors: 4; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 4; (11)Index of Refraction: 1.623; (12)Molar Refractivity: 75.08 cm³; (13)Molar Volume: 212.7 cm³; (14)Surface Tension: 48.7 dyne/cm; (15)Density: 1.4 g/cm³; (16)Flash Point: 230.5 °C; (17)Enthalpy of Vaporization: 75.63 kJ/mol; (18)Boiling Point: 457.6 °C at 760 mmHg; (19)Vapour Pressure: 3.63E-09 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc2cc(Cl)cc(n1ncc(c1CCC)C(=O)O)c2
(2)InChI: InChI=1/C13H12Cl2N2O2/c1-2-3-12-11(13(18)19)7-16-17(12)10-5-8(14)4-9(15)6-10/h4-7H,2-3H2,1H3,(H,18,19)
(3)InChIKey: CIAUICOJDLJNBL-UHFFFAOYAK

Product Name

1-(3,5-DICHLOROPHENYL)-5-PROPYL-1H-PYRAZOLE-4-CARBOXYLIC ACID

1H-Pyrazole-4-carboxylicacid, 1-(3,5-dichlorophenyl)-5-propyl- Specification

Related Products

Hot Products