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1451391-06-2 | 1H-Pyrazol-3-amine, 5-(1-fluoroethyl)-
CAS No: 1451391-06-2 Catalog No: AG001KM2 MDL No:MFCD22690772
Product Description
Catalog Number:
AG001KM2
Chemical Name:
1H-Pyrazol-3-amine, 5-(1-fluoroethyl)-
CAS Number:
1451391-06-2
Molecular Formula:
C5H8FN3
Molecular Weight:
129.1355
MDL Number:
MFCD22690772
IUPAC Name:
5-(1-fluoroethyl)-1H-pyrazol-3-amine
InChI:
InChI=1S/C5H8FN3/c1-3(6)4-2-5(7)9-8-4/h2-3H,1H3,(H3,7,8,9)
InChI Key:
FARUXUWYPBJAIM-UHFFFAOYSA-N
SMILES:
CC(c1cc(n[nH]1)N)F
Properties
Complexity:
98.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
129.07g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
129.138g/mol
Monoisotopic Mass:
129.07g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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