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17823-38-0 | Benzonitrile, 4-amino-2,3,5,6-tetrafluoro-
CAS No: 17823-38-0 Catalog No: AG0025UO MDL No:
Product Description
Catalog Number:
AG0025UO
Chemical Name:
Benzonitrile, 4-amino-2,3,5,6-tetrafluoro-
CAS Number:
17823-38-0
Molecular Formula:
C7H2F4N2
Molecular Weight:
190.0978
IUPAC Name:
4-amino-2,3,5,6-tetrafluorobenzonitrile
InChI:
InChI=1S/C7H2F4N2/c8-3-2(1-12)4(9)6(11)7(13)5(3)10/h13H2
InChI Key:
ZFQKTZQBBRHWPC-UHFFFAOYSA-N
SMILES:
N#Cc1c(F)c(F)c(c(c1F)F)N
EC Number:
241-783-0
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.015g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.101g/mol
Monoisotopic Mass:
190.015g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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