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Home > Fluorides > 1499818-92-6
1499818-92-6 | Isoquinoline, 6,8-difluoro-
CAS No: 1499818-92-6 Catalog No: AG001M6C MDL No:MFCD22097469
Product Description
Catalog Number:
AG001M6C
Chemical Name:
Isoquinoline, 6,8-difluoro-
CAS Number:
1499818-92-6
Molecular Formula:
C9H5F2N
Molecular Weight:
165.1395
MDL Number:
MFCD22097469
IUPAC Name:
6,8-difluoroisoquinoline
InChI:
InChI=1S/C9H5F2N/c10-7-3-6-1-2-12-5-8(6)9(11)4-7/h1-5H
InChI Key:
TUURPHCVSJQJIQ-UHFFFAOYSA-N
SMILES:
Fc1cc2ccncc2c(c1)F
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.039g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.143g/mol
Monoisotopic Mass:
165.039g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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