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68290-36-8 | 2-(3,4-DIFLUOROPHENYL)INDOLE
CAS No: 68290-36-8 Catalog No: AG00FBAL MDL No:MFCD00068180
Product Description
Catalog Number:
AG00FBAL
Chemical Name:
2-(3,4-DIFLUOROPHENYL)INDOLE
CAS Number:
68290-36-8
Molecular Formula:
C14H9F2N
Molecular Weight:
229.2248
MDL Number:
MFCD00068180
IUPAC Name:
2-(3,4-difluorophenyl)-1H-indole
InChI:
InChI=1S/C14H9F2N/c15-11-6-5-10(7-12(11)16)14-8-9-3-1-2-4-13(9)17-14/h1-8,17H
InChI Key:
KCJSNAZSJSHQCC-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1F)c1cc2c([nH]1)cccc2
Properties
Complexity:
271
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.07g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.23g/mol
Monoisotopic Mass:
229.07g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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