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20925-85-3 | Benzonitrile, 2,3,4,5,6-pentachloro-
CAS No: 20925-85-3 Catalog No: AG002K4Z MDL No:MFCD00173666
Product Description
Catalog Number:
AG002K4Z
Chemical Name:
Benzonitrile, 2,3,4,5,6-pentachloro-
CAS Number:
20925-85-3
Molecular Formula:
C7Cl5N
Molecular Weight:
275.3466
MDL Number:
MFCD00173666
IUPAC Name:
2,3,4,5,6-pentachlorobenzonitrile
InChI:
InChI=1S/C7Cl5N/c8-3-2(1-13)4(9)6(11)7(12)5(3)10
InChI Key:
INICGXSKJYKEIV-UHFFFAOYSA-N
SMILES:
N#Cc1c(Cl)c(Cl)c(c(c1Cl)Cl)Cl
UNII:
AT5H4XYT8P
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.844g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
275.334g/mol
Monoisotopic Mass:
272.847g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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