Home Other Building Blocks 1-ethyl-6-fluoro-1H-1,3-benzodiazol-2-amine

1-ethyl-6-fluoro-1H-1,3-benzodiazol-2-amine

CAS No.:
1247481-75-9
Catalog Number:
AG01A590
Molecular Formula:
C9H10FN3
Molecular Weight:
179.1942
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Product Description
Catalog Number:
AG01A590
Chemical Name:
1-ethyl-6-fluoro-1H-1,3-benzodiazol-2-amine
CAS Number:
1247481-75-9
Molecular Formula:
C9H10FN3
Molecular Weight:
179.1942
MDL Number:
MFCD16841036
IUPAC Name:
1-ethyl-6-fluorobenzimidazol-2-amine
InChI:
InChI=1S/C9H10FN3/c1-2-13-8-5-6(10)3-4-7(8)12-9(13)11/h3-5H,2H2,1H3,(H2,11,12)
InChI Key:
UCRCMDCTLLABSP-UHFFFAOYSA-N
SMILES:
CCn1c(N)nc2c1cc(F)cc2
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.086g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
179.198g/mol
Monoisotopic Mass:
179.086g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties