Chemical Properties of Methiocarb (CAS 2032-65-7)

InChI

InChI=1S/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)

InChI Key

YFBPRJGDJKVWAH-UHFFFAOYSA-N

Formula

C11H15NO2S

SMILES

CNC(=O)Oc1cc(C)c(SC)c(C)c1

Molecular Weight¹

225.31

CAS

2032-65-7

Other Names

• (3,5-dimethyl-4-methylsulfanylphenyl) N-methylcarbamate
• 3,5-Dimethyl-4-(Methylthio)phenyl methylcarbamate
• 3,5-Dimethyl-4-(methylthio)phenol methylcarbamate
• 3,5-Dimethyl-4-methyl-thiophenyl-N-carbamat
• 3,5-Dimethyl-4-methylthiophenyl N-methylcarbamate
• 3,5-Xylenol, 4-(methylthio)-, methylcarbamate
• 4-(Methylthio)-3,5-dimethylphenyl methylcarbamate
• 4-(Methylthio)-3,5-xylyl methylcarbamate
• 4-Methylmercapto-3,5-dimethylphenyl N-methylcarbamate
• 4-Methylmercapto-3,5-xylyl methylcarbamate
• B 37344
• BAY 37344
• BAY 5024
• BAY 9026
• BAYER 37344
• Carbamic acid, 3,5-dimethyl-4-methylthiophenyl ester, N-methyl
• Carbamic acid, N-methyl-, 4-(methylthio)-3,5-xylyl ester
• Carbamic acid, methyl-, 3,5-dimethyl-4-(methylthio)phenyl ester
• Carbamic acid, methyl-, 4-(methylthio)-3,5-xylyl ester
• Club
• DCR 736
• Draza
• ENT 25,726
• H 321
• Mercaptodimethur
• Mesurol
• Mesurol phenol
• Methiocarbe
• Methyl carbamic acid 4-(methylthio)-3,5-xylyl ester
• Metmercapturan
• Metmercapturon
• OMS-93
• Phenol, 3,5-dimethyl-4-(methylthio)-, methylcarbamate
• Phenyl-3,5-dimethyl-4-(methylthio)-, methylcarbamate
• SD 9228

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_fusH : Enthalpy of fusion at a given temperature (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).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfG°	13.85	kJ/mol	Joback Calculated Property
ΔfH°gas	-217.71	kJ/mol	Joback Calculated Property
ΔfusH°	29.14	kJ/mol	Joback Calculated Property
ΔvapH°	66.75	kJ/mol	Joback Calculated Property
log10WS	-3.92		Aq. Sol...
logPoct/wat	2.744		Crippen Calculated Property
McVol	175.860	ml/mol	McGowan Calculated Property
Pc	2735.42	kPa	Joback Calculated Property
Inp	[1915.00; 1956.00]
Inp	1915.00		NIST
Inp	1956.00		NIST
Tboil	687.94	K	Joback Calculated Property
Tc	915.89	K	Joback Calculated Property
Tfus	[394.44; 394.80]	K
Tfus	394.44 ± 0.20	K	NIST
Tfus	394.80 ± 0.20	K	NIST
Vc	0.656	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[445.93; 513.43]	J/mol×K	[687.94; 915.89]
Cp,gas	445.93	J/mol×K	687.94	Joback Calculated Property
Cp,gas	459.40	J/mol×K	725.93	Joback Calculated Property
Cp,gas	471.99	J/mol×K	763.92	Joback Calculated Property
Cp,gas	483.69	J/mol×K	801.91	Joback Calculated Property
Cp,gas	494.49	J/mol×K	839.91	Joback Calculated Property
Cp,gas	504.41	J/mol×K	877.90	Joback Calculated Property
Cp,gas	513.43	J/mol×K	915.89	Joback Calculated Property
ΔfusH	[30.36; 30.36]	kJ/mol	[393.80; 393.80]
ΔfusH	30.36	kJ/mol	393.80	NIST
ΔfusH	30.36	kJ/mol	393.80	NIST

Similar Compounds

Find more compounds similar to Methiocarb.

Sources

• Crippen Method
• Joback Method
• Aqueous Solubility Prediction 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.