Home Other Building Blocks 5-[4-(difluoromethoxy)phenyl]-1,2,4-triazin-3-amine

5-[4-(difluoromethoxy)phenyl]-1,2,4-triazin-3-amine

CAS No.:
1094271-28-9
Catalog Number:
AG019X6A
Molecular Formula:
C10H8F2N4O
Molecular Weight:
238.1935
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Product Description
Catalog Number:
AG019X6A
Chemical Name:
5-[4-(difluoromethoxy)phenyl]-1,2,4-triazin-3-amine
CAS Number:
1094271-28-9
Molecular Formula:
C10H8F2N4O
Molecular Weight:
238.1935
MDL Number:
MFCD11185356
IUPAC Name:
5-[4-(difluoromethoxy)phenyl]-1,2,4-triazin-3-amine
InChI:
InChI=1S/C10H8F2N4O/c11-9(12)17-7-3-1-6(2-4-7)8-5-14-16-10(13)15-8/h1-5,9H,(H2,13,15,16)
InChI Key:
PFMAPGSSGCWCJF-UHFFFAOYSA-N
SMILES:
FC(Oc1ccc(cc1)c1cnnc(n1)N)F
Properties
Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.067g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
238.198g/mol
Monoisotopic Mass:
238.067g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
73.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties