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55040-11-4

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Basic Information
CAS No.: 55040-11-4
Name: (QUINAZOLIN-4-YLAMINO)-ACETIC ACID
Molecular Structure:
Molecular Structure of 55040-11-4 ((QUINAZOLIN-4-YLAMINO)-ACETIC ACID)
Formula: C10H9N3O2
Molecular Weight: 203.2
Synonyms: 4-Quinazolinylaminoaceticacid;
Density: 1.445 g/cm3
Boiling Point: 479.4 °C at 760 mmHg
Flash Point: 243.7 °C
Hazard Symbols: Xn
Risk Codes: 22
PSA: 75.11000
LogP: 1.19930
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Specification

The Glycine,N-4-quinazolinyl- is an organic compound with the formula C10H9N3O2. The IUPAC name of this chemical is 2-(Quinazolin-4-ylamino)acetic acid. With the CAS registry number 55040-11-4, it is also named as N-Quinazolin-4-ylglycine. Besides, its molecular weight is 203.2.

Physical properties about Glycine,N-4-quinazolinyl- are: (1)ACD/LogP: -0.71; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 5; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 55.32 Å2; (10)Index of Refraction: 1.729; (11)Molar Refractivity: 56.08 cm3; (12)Molar Volume: 140.5 cm3; (13)Polarizability: 22.23×10-24 cm3; (14)Surface Tension: 79.5 dyne/cm; (15)Density: 1.445 g/cm3; (16)Flash Point: 243.7 °C; (17)Enthalpy of Vaporization: 78.34 kJ/mol; (18)Boiling Point: 479.4 °C at 760 mmHg; (19)Vapour Pressure: 5.33E-10 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C10H9N3O2/c14-9(15)5-11-10-7-3-1-2-4-8(7)12-6-13-10/h1-4,6H,5H2,(H,14,15)(H,11,12,13)
(2)InChIKey: GQLYDNMTAYXPLC-UHFFFAOYAY
(3)Std. InChI: InChI=1S/C10H9N3O2/c14-9(15)5-11-10-7-3-1-2-4-8(7)12-6-13-10/h1-4,6H,5H2,(H,14,15)(H,11,12,13)
(4)Std. InChIKey: GQLYDNMTAYXPLC-UHFFFAOYSA-N