CAS No.932702-23-3,Ethyl 6-aminobenzo[d]isoxazole-3-carboxylate Suppliers

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Basic Information

Molecular Structure:
CAS No.:	932702-23-3
Name:	Ethyl 6-aminobenzo[d]isoxazole-3-carboxylate
Article Data:	2

Formula:	C₁₀H₁₀N₂O₃
Molecular Weight:	206.201
Synonyms:	6-Amino-1,2-benzisoxazole-3-carboxylic acid ethyl ester;
Density:	1.319 g/cm³
Boiling Point:	385.7 °C at 760 mmHg
Flash Point:	187.1 °C
PSA:	78.35000
LogP:	2.16790

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Specification

The CAS register number of Ethyl 6-aminobenzo[d]isoxazole-3-carboxylate is 932702-23-3. It also can be called as 6-Amino-1,2-benzisoxazole-3-carboxylic acid ethyl ester and the systematic name about this chemical is 1,2-benzisoxazole-3-carboxylic acid, 6-amino-, ethyl ester. The molecular formula about this chemical is C₁₀H₁₀N₂O₃ and the molecular weight is 206.2.

Physical properties about Ethyl 6-aminobenzo[d]isoxazole-3-carboxylate are: (1)ACD/LogP: 0.86; (2)ACD/LogD (pH 5.5): 0.86; (3)ACD/LogD (pH 7.4): 0.86; (4)ACD/BCF (pH 5.5): 2.64; (5)ACD/BCF (pH 7.4): 2.64; (6)ACD/KOC (pH 5.5): 69.69; (7)ACD/KOC (pH 7.4): 69.69; (8)#H bond acceptors: 5; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 78.35 Å²; (12)Index of Refraction: 1.623; (13)Molar Refractivity: 55.12 cm³; (14)Molar Volume: 156.2 cm³; (15)Polarizability: 21.85x10^-24cm³; (16)Surface Tension: 57.2 dyne/cm; (17)Density: 1.319 g/cm³; (18)Flash Point: 187.1 °C; (19)Enthalpy of Vaporization: 63.45 kJ/mol; (20)Boiling Point: 385.7 °C at 760 mmHg; (21)Vapour Pressure: 3.74E-06 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: CCOC(=O)c1c2ccc(cc2on1)N
(2)InChI: InChI=1/C10H10N2O3/c1-2-14-10(13)9-7-4-3-6(11)5-8(7)15-12-9/h3-5H,2,11H2,1H3
(3)InChIKey: ABHHOWURTXVLBH-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C10H10N2O3/c1-2-14-10(13)9-7-4-3-6(11)5-8(7)15-12-9/h3-5H,2,11H2,1H3
(5)Std. InChIKey: ABHHOWURTXVLBH-UHFFFAOYSA-N