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Home > Nitro Compounds > 84570-89-8
84570-89-8 | Quinazoline, 1,2,3,4-tetrahydro-4-methyl-2-(4-nitrophenyl)-
CAS No: 84570-89-8 Catalog No: AG004R0M MDL No:
Product Description
Catalog Number:
AG004R0M
Chemical Name:
Quinazoline, 1,2,3,4-tetrahydro-4-methyl-2-(4-nitrophenyl)-
CAS Number:
84570-89-8
Molecular Formula:
C15H15N3O2
Molecular Weight:
269.2985
IUPAC Name:
4-methyl-2-(4-nitrophenyl)-1,2,3,4-tetrahydroquinazoline
InChI:
InChI=1S/C15H15N3O2/c1-10-13-4-2-3-5-14(13)17-15(16-10)11-6-8-12(9-7-11)18(19)20/h2-10,15-17H,1H3
InChI Key:
OGCUASVESUFADR-UHFFFAOYSA-N
SMILES:
CC1NC(Nc2c1cccc2)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
350
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.116g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
269.304g/mol
Monoisotopic Mass:
269.116g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
69.9A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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