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120047-50-9 | 1H-Pyrrole, 2,5-difluoro-
CAS No: 120047-50-9 Catalog No: AG000Q6X MDL No:
Product Description
Catalog Number:
AG000Q6X
Chemical Name:
1H-Pyrrole, 2,5-difluoro-
CAS Number:
120047-50-9
Molecular Formula:
C4H3F2N
Molecular Weight:
103.0701
IUPAC Name:
2,5-difluoro-1H-pyrrole
InChI:
InChI=1S/C4H3F2N/c5-3-1-2-4(6)7-3/h1-2,7H
InChI Key:
WIYDXQXZMOYTEK-UHFFFAOYSA-N
SMILES:
Fc1ccc([nH]1)F
Properties
Complexity:
58.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
103.023g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
103.072g/mol
Monoisotopic Mass:
103.023g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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