Chemical Properties of Acetone, methylthio, PFBO # 1

Acetone, methylthio, PFBO # 1

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InChI
InChI=1S/C10H8F5NOS/c1-4(3-18)16-17-2-5-6(11)8(13)10(15)9(14)7(5)12/h18H,2-3H2,1H3
InChI Key
SZRMFYIXEKJNFX-UHFFFAOYSA-N
Formula
C10H8F5NOS
SMILES
CC(CS)=NOCc1c(F)c(F)c(F)c(F)c1F
Molecular Weight1
285.23
Sources

Physical Properties

Property Value Unit Source
Δfgas -1072.41 kJ/mol Joback Calculated Property
Δvap 51.90 kJ/mol Joback Calculated Property
logPoct/wat 3.20 Crippen Calculated Property
Pc 2066.12 kPa Joback Calculated Property
Tboil 637.97 K Joback Calculated Property
Tc 836.25 K Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-F 5
-N= 1
=C< (ring) 6
-CH2- 2
=C< 1
-SH 1
-CH3 1

Similar Compounds

Acetone, methylthio, PFBO # 2. 3-Mercapto-2-butanone, PFBO # 1. Ethanal, PFBO # 1. Acetaldehyde oxime, O-[(pentafluorophenyl)methyl]-. 2-Butanone, PFBO # 1. Butanal, PFBO # 1. Propenal O-pentafluorophenylmethyl-oxime. 2-Propenal, PFBO # 1. Pentanal, PFBO # 1. n-Pentanal oxime, O-[(pentafluorophenyl)methyl]-. 3-Mercapto-2-pentanone, PFBO # 2. 3-Mercapto-2-pentanone, PFBO # 1. Glycoldial, bis-O-pentafluorobenzyloxime. (E)-2-Butenal, PFBO # 1. Hexanal, PFBO # 1.

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