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1053656-20-4 | 2-(5,6-Difluoro-1H-benzoimidazol-2-yl)ethylamine
CAS No: 1053656-20-4 Catalog No: AG01F9F2 MDL No:
Product Description
Catalog Number:
AG01F9F2
Chemical Name:
2-(5,6-Difluoro-1H-benzoimidazol-2-yl)ethylamine
CAS Number:
1053656-20-4
Molecular Formula:
C9H9F2N3
Molecular Weight:
197.1847
IUPAC Name:
2-(5,6-difluoro-1H-benzimidazol-2-yl)ethanamine
InChI:
InChI=1S/C9H9F2N3/c10-5-3-7-8(4-6(5)11)14-9(13-7)1-2-12/h3-4H,1-2,12H2,(H,13,14)
InChI Key:
YQCIBXFRZZFWPY-UHFFFAOYSA-N
SMILES:
NCCc1[nH]c2c(n1)cc(c(c2)F)F
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.076g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
197.189g/mol
Monoisotopic Mass:
197.076g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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