Chemical Properties of Butocarboxim (CAS 34681-10-2)

InChI

InChI=1S/C7H14N2O2S/c1-5(6(2)12-4)9-11-7(10)8-3/h6H,1-4H3,(H,8,10)

InChI Key

SFNPDDSJBGRXLW-UHFFFAOYSA-N

Formula

C7H14N2O2S

SMILES

CNC(=O)ON=C(C)C(C)SC

Molecular Weight¹

190.26

CAS

34681-10-2

Other Names

• 2-Butanone, 3-(methylthio)-, O-[(methylamino)carbonyl]oxime
• 2-Butanone, 3-(methylthio)-, O-(N-methylcarbamoyl)oxime
• Afiline
• Butocarboxime
• CO 755
• Drawin 755
• 3-(Methylthio)-2-butanone O-((methylamino)carbonyl)oxime
• 3-(Methylthio)butanone O-methylcarbamoyloxime
• 3-(Methylthio)-2-butanone O-(methylcarbamoyl)oxime
• 3-(Methylthio)-O-((methylamino)carbonyl)oxime-2-butanone
• 2-Methylthio-O-(N-methylcarbamoyl)-butanonoxim-3
• 2-(([(Methylamino)carbonyl]oxy)imino)-3-(methylsulfanyl)butane

• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-270.12	kJ/mol	Joback Calculated Property
ΔvapH°	56.59	kJ/mol	Joback Calculated Property
log10WS	-1.93		Crippen Calculated Property
logPoct/wat	1.470		Crippen Calculated Property
McVol	148.940	ml/mol	McGowan Calculated Property
Pc	2752.67	kPa	Joback Calculated Property
Inp	[1550.00; 1571.00]
Inp	1550.00		NIST
Inp	1560.00		NIST
Inp	1571.00		NIST
Inp	1550.00		NIST
Tboil	630.92	K	Joback Calculated Property
Tc	852.06	K	Joback Calculated Property

Similar Compounds

Find more compounds similar to Butocarboxim.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.