Chemical Properties of 1,2-Bis(chloromethyl)-4,5-dimethylbenzene (CAS 2362-16-5)

InChI

InChI=1S/C10H12Cl2/c1-7-3-9(5-11)10(6-12)4-8(7)2/h3-4H,5-6H2,1-2H3

InChI Key

UIMFHDVFMPUGMO-UHFFFAOYSA-N

Formula

C10H12Cl2

SMILES

Cc1cc(CCl)c(CCl)cc1C

Molecular Weight¹

203.11

CAS

2362-16-5

Other Names

• Benzene, 1,2-bis-(chloromethyl)-4,5-dimethyl
• 1,2-Dimethyl-4,5-bis(chloromethyl)benzene

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• IE : Ionization energy (eV).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.4935		Relay (1.0) Calculated Property
ΔfG°	92.98	kJ/mol	Joback Calculated Property
ΔfH°gas	-96.90	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	22.92	kJ/mol	Joback Calculated Property
IE	8.48	eV	Relay (1.0) Calculated Property
log10WS	-4.87		Relay (1.0) Calculated Property
logPoct/wat	3.781		Crippen Calculated Property
McVol	152.480	ml/mol	McGowan Calculated Property
Pc	2587.22	kPa	Joback Calculated Property
Inp	[1530.00; 1542.00]
Inp	1542.00		NIST
Inp	1530.00		NIST
Tboil	547.76	K	Relay (1.0) Calculated Property
Tc	770.04	K	Relay (1.0) Calculated Property
Tfus	367.78	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Enthalpy of vaporization at standard conditions for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[311.74; 376.93]	J/mol×K	[544.88; 764.01]
Cp,gas	311.74	J/mol×K	544.88	Joback Calculated Property
Cp,gas	324.25	J/mol×K	581.40	Joback Calculated Property
Cp,gas	336.07	J/mol×K	617.92	Joback Calculated Property
Cp,gas	347.23	J/mol×K	654.44	Joback Calculated Property
Cp,gas	357.74	J/mol×K	690.97	Joback Calculated Property
Cp,gas	367.63	J/mol×K	727.49	Joback Calculated Property
Cp,gas	376.93	J/mol×K	764.01	Joback Calculated Property
η	[0.0002243; 0.0013745]	Pa×s	[326.28; 544.88]
η	0.0013745	Pa×s	326.28	Joback Calculated Property
η	0.0008730	Pa×s	362.71	Joback Calculated Property
η	0.0006024	Pa×s	399.15	Joback Calculated Property
η	0.0004423	Pa×s	435.58	Joback Calculated Property
η	0.0003406	Pa×s	472.01	Joback Calculated Property
η	0.0002723	Pa×s	508.45	Joback Calculated Property
η	0.0002243	Pa×s	544.88	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,2-Bis(chloromethyl)-4,5-dimethylbenzene.

Sources

• Cheméo Relay (1.0)
• 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.
These property values are available through the Cheméo API. A free account gives you an access key.