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119584-79-1

119584-79-1 | 2,4-Quinazolinediamine, 8-fluoro-

CAS No: 119584-79-1 Catalog No: AG000IZK MDL No:MFCD02323636

Product Description

Catalog Number:
AG000IZK
Chemical Name:
2,4-Quinazolinediamine, 8-fluoro-
CAS Number:
119584-79-1
Molecular Formula:
C8H7FN4
Molecular Weight:
178.1664
MDL Number:
MFCD02323636
IUPAC Name:
8-fluoroquinazoline-2,4-diamine
InChI:
InChI=1S/C8H7FN4/c9-5-3-1-2-4-6(5)12-8(11)13-7(4)10/h1-3H,(H4,10,11,12,13)
InChI Key:
OMZWXLZTWRYIJS-UHFFFAOYSA-N
SMILES:
Nc1nc(N)c2c(n1)c(F)ccc2

Properties

Complexity:
189  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.065g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
178.17g/mol
Monoisotopic Mass:
178.065g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  

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