3-(4-Methoxyphenyl)-1-methyl-1H-pyrazol-5-amine supplier

Name
3-(4-Methoxyphenyl)-1-methyl-1H-pyrazol-5-amine
EINECS
CAS No. 92469-35-7
Article Data3
CAS DataBase
Density 1.19 g/cm³
Solubility
Melting Point 140-141 °C
Formula C₁₁H₁₃N₃O
Boiling Point 401.6 °C at 760 mmHg
Molecular Weight 203.24
Flash Point 196.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-(4-Methoxyphenyl)-1-methyl-1H-pyrazol-5-amine;5-(4-Methoxyphenyl)-2-Methylpyrazol-3-aMine
PSA 53.07000
LogP 2.25910

3-(4-Methoxyphenyl)-1-methyl-1H-pyrazol-5-amine Specification

The 3-(4-Methoxyphenyl)-1-methyl-1H-pyrazol-5-amine, with CAS registry number 92469-35-7, has the systematic name of 3-(4-methoxyphenyl)-1-methyl-1H-pyrazol-5-amine. Besides this, it is also called 1H-pyrazol-5-amine, 3-(4-methoxyphenyl)-1-methyl-. And the chemical formula of this chemical is C₁₁H₁₃N₃O.

Physical properties about this chemical are: (1)ACD/LogP: 0.18; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.17; (4)ACD/LogD (pH 7.4): 0.18; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 29.44; (8)ACD/KOC (pH 7.4): 29.84; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 30.29 Å²; (13)Index of Refraction: 1.6; (14)Molar Refractivity: 58.08 cm³; (15)Molar Volume: 169.6 cm³; (16)Polarizability: 23.02×10^-24cm³; (17)Surface Tension: 43 dyne/cm; (18)Enthalpy of Vaporization: 65.26 kJ/mol; (19)Vapour Pressure: 1.17E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O(c1ccc(cc1)c2nn(c(N)c2)C)C
(2)InChI: InChI=1/C11H13N3O/c1-14-11(12)7-10(13-14)8-3-5-9(15-2)6-4-8/h3-7H,12H2,1-2H3
(3)InChIKey: OSVZDKNTAGWKQX-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C11H13N3O/c1-14-11(12)7-10(13-14)8-3-5-9(15-2)6-4-8/h3-7H,12H2,1-2H3
(5)Std. InChIKey: OSVZDKNTAGWKQX-UHFFFAOYSA-N

Product Name

3-(4-Methoxyphenyl)-1-methyl-1H-pyrazol-5-amine

3-(4-Methoxyphenyl)-1-methyl-1H-pyrazol-5-amine Specification

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