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939968-16-8 | 1-{4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl}ethan-1-one
CAS No: 939968-16-8 Catalog No: AG01FLBL MDL No:
Product Description
Catalog Number:
AG01FLBL
Chemical Name:
1-{4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl}ethan-1-one
CAS Number:
939968-16-8
IUPAC Name:
1-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)ethanone
InChI:
InChI=1S/C8H8N4O/c1-5(13)6-2-3-7-8(9)10-4-11-12(6)7/h2-4H,1H3,(H2,9,10,11)
InChI Key:
GEGNHQIPOMSPJV-UHFFFAOYSA-N
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.07g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
176.179g/mol
Monoisotopic Mass:
176.07g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
73.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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