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PCB 98

PCB 98 structure

CAS No:
60233-25-2
Formula:
C12H5Cl5
Chemical Name:
PCB 98
Synonyms:
1,1′-Biphenyl,2,2′,3,4′,6′-pentachloro-;2,2′,3,4′,6′-Pentachloro-1,1′-biphenyl;2,3,2′,4′,6′-Pentachlorobiphenyl;2,2′,3′,4,6-Pentachlorobiphenyl;PCB 98;2,2′,3,4′,6′-Pentachlorobiphenyl
Categories:
Analytical Chemistry > Food Safety

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PCB 98 Basic Attributes

Molecular Weight：

326.43

Exact Mass：

326.43

UNII：

AP7H9MK079

DSSTox ID：

DTXSID9074193

Characteristics

PSA：

XLogP3：

6.62060

Density：

1.522g/cm3

Melting Point：

95.86°C (estimate)

Boiling Point：

358.9ºC at 760 mmHg

Flash Point：

168.9ºC

Refractive Index：

1.619

Water Solubility：

3.98e-08 M

Computed Properties

Molecular Weight:326.4
XLogP3:6.3
Rotatable Bond Count:1
Exact Mass:325.880439
Monoisotopic Mass:323.883389
Heavy Atom Count:17
Complexity:247
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes