Product Name: 4-(2-Hydroxyethylamino)-2-(5-nitro-2-thienyl)quinazoline (CAS NO.33389-36-5)
Molecular Formula: C14H12N4O3S
Molecular Weight: 316.3351g/mol
Mol File: 33389-36-5.mol
Boiling point: 480.6 °C at 760 mmHg
Flash Point: 244.5 °C
Density: 1.505 g/cm3
Surface Tension: 79.2 dyne/cm
Enthalpy of Vaporization: 78.49 kJ/mol
Vapour Pressure: 4.78E-10 mmHg at 25°C
XLogP3-AA: 2.7
H-Bond Donor: 2
H-Bond Acceptor: 6
Structure Descriptors of 4-(2-Hydroxyethylamino)-2-(5-nitro-2-thienyl)quinazoline (CAS NO.33389-36-5):
IUPAC Name: 2-[[2-(5-Nitrothiophen-2-yl)quinazolin-4-yl]amino]ethanol
Canonical SMILES: C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=C(S3)[N+](=O)[O-])NCCO
InChI: InChI=1S/C14H12N4O3S/c19-8-7-15-13-9-3-1-2-4-10(9)16-14(17-13)11-5-6-12(22-11)18(20)21/h1-6,19H,7-8H2,(H,15,16,17)
InChIKey: QPLQHOGBXHYUEB-UHFFFAOYSA-N
1. | mma-sat 1250 µg/plate | CNREA8 Cancer Research. 35 (1975),3611. |
Questionable carcinogen with experimental carcinogenic data. Mutation data reported. When heated to decomposition it emits very toxic fumes of NOx and SOx.
4-(2-Hydroxyethylamino)-2-(5-nitro-2-thienyl)quinazoline , its CAS NO. is 33389-36-5, the synonyms are -(2-(5-Nitro-2-thienyl)-4-quinazolinyl)aminoethanol ; BRN 0571134 ; CCRIS 1076 ; Quinazoline, 4-(2-hydroxyethylamino)-2-(5-nitro-2-thienyl)- .
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