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Name	1-Isopropyl-1H-imidazole-4-carboxylic acid	EINECS	N/A
CAS No.	917364-12-6	Density	1.23 g/cm³
PSA	55.12000	LogP	1.16220
Solubility	N/A	Melting Point	N/A
Formula	C₇H₁₀N₂O₂	Boiling Point	361.9 °C at 760 mmHg
Molecular Weight	154.17	Flash Point	172.7 °C
Transport Information	N/A	Appearance	N/A
Safety		Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	1-Isopropyl-1H-imidazole-4-carboxylicacid;	Article Data	4

1-Isopropyl-1H-imidazole-4-carboxylic acid Specification

The CAS register number of 1-Isopropyl-1H-imidazole-4-carboxylic acid is 917364-12-6. It also can be called as 1H-Imidazole-4-carboxylicacid, 1-(1-methylethyl)- and the systematic name about this chemical is 1-isopropylimidazole-4-carboxylic acid.

Physical properties about 1-Isopropyl-1H-imidazole-4-carboxylic acid are: (1)ACD/LogP:0.35; (2)#H bond acceptors:4; (3)#H bond donors:1; (4)#Freely Rotating Bonds:2; (5)Polar Surface Area:55.12Å²; (6)Index of Refraction:1.563; (7)Molar Refractivity:40.59 cm³; (8)Molar Volume:124.9 cm³; (9)Polarizability:16.09x10^-24cm³; (10)Surface Tension:43 dyne/cm; (11)Enthalpy of Vaporization:64.12 kJ/mol; (12)Boiling Point:361.9 °C at 760 mmHg; (13)Vapour Pressure:7.19E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)n1cc(nc1)C(=O)O
(2)InChI: InChI=1/C7H10N2O2/c1-5(2)9-3-6(7(10)11)8-4-9/h3-5H,1-2H3,(H,10,11)
(3)InChIKey: XFCGFENUIALWFJ-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C7H10N2O2/c1-5(2)9-3-6(7(10)11)8-4-9/h3-5H,1-2H3,(H,10,11)
(5)Std. InChIKey: XFCGFENUIALWFJ-UHFFFAOYSA-N

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