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943528-40-3 | 2,4,6-Tribromo-3,5-difluorobenzonitrile
CAS No: 943528-40-3 Catalog No: AG003AFU MDL No:MFCD27933955
Product Description
Catalog Number:
AG003AFU
Chemical Name:
2,4,6-Tribromo-3,5-difluorobenzonitrile
CAS Number:
943528-40-3
Molecular Formula:
C7Br3F2N
Molecular Weight:
375.7904
MDL Number:
MFCD27933955
IUPAC Name:
2,4,6-tribromo-3,5-difluorobenzonitrile
InChI:
InChI=1S/C7Br3F2N/c8-3-2(1-13)4(9)7(12)5(10)6(3)11
InChI Key:
AQPZRWDNSAKHNA-UHFFFAOYSA-N
SMILES:
N#Cc1c(Br)c(F)c(c(c1Br)F)Br
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.753g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
375.793g/mol
Monoisotopic Mass:
372.755g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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