Chemical Properties of Phosgard b52r (monsanto) (CAS 25079-53-2)

Phosgard b52r (monsanto)

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InChI
InChI=1S/C14H24Br4Cl4O6P2/c1-10(28-30(24,14(2-15)6-22)27-9-13(18)5-21)29(23,25-7-11(16)3-19)26-8-12(17)4-20/h10-14H,2-9H2,1H3
InChI Key
KINBREMVZFOQIJ-UHFFFAOYSA-N
Formula
C14H24Br4Cl4O6P2
SMILES
CC(OP(=O)(OCC(Br)CCl)C(CCl)CBr)P(=O)(OCC(Br)CCl)OCC(Br)CCl
Molecular Weight1
811.71
CAS
25079-53-2
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Physical Properties

Property Value Unit Source
ω 1.0648 Relay (... Calculated Property
ΔfG° -786.71 kJ/mol Relay (... Calculated Property ⚠️
ΔfH°gas -1428.95 kJ/mol Relay (... Calculated Property
ΔvapH° 133.76 kJ/mol Relay (... Calculated Property
IE 9.69 eV Relay (... Calculated Property
log10WS -6.16 Relay (... Calculated Property
logPoct/wat 7.794 Crippen Calculated Property
McVol 403.220 ml/mol McGowan Calculated Property
Pc 1447.53 kPa Relay (... Calculated Property ⚠️
Tboil 769.01 K Relay (... Calculated Property
Tc 1003.43 K Relay (... Calculated Property
Tfus 347.74 K Relay (... Calculated Property
Vc 1.321 m3/kmol Relay (... Calculated Property

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Sources

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