Chemical Properties of 2,5-Dimethylbenzyl chloride (CAS 824-45-3)

2,5-Dimethylbenzyl chloride

InChI
InChI=1S/C9H11Cl/c1-7-3-4-8(2)9(5-7)6-10/h3-5H,6H2,1-2H3
InChI Key
PECXPZGFZFGDRD-UHFFFAOYSA-N
Formula
C9H11Cl
SMILES
Cc1ccc(C)c(CCl)c1
Molecular Weight1
154.64
CAS
824-45-3
Other Names
  • 1,4-Dimethyl-2-(chloromethyl)benzene
  • 1-Chloromethyl-2,5-dimethylbenzene
  • 2-Chloromethyl-p-xylene
  • Benzene, 2-(chloromethyl)-1,4-dimethyl-
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Physical Properties

Property Value Unit Source
ω 0.4008 Relay (1.0) Calculated Property
ΔfG° 106.12 kJ/mol Joback Calculated Property
ΔfH°gas -51.68 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 16.53 kJ/mol Joback Calculated Property
ΔvapH° 57.17 kJ/mol Relay (1.0) Calculated Property
IE 8.57 eV Relay (1.0) Calculated Property
log10WS -3.48 Relay (1.0) Calculated Property
logPoct/wat 3.042 Crippen Calculated Property
McVol 126.150 ml/mol McGowan Calculated Property
Pc 3025.61 kPa Joback Calculated Property
Inp [1228.00; 1231.00]   Show Hide
Inp 1231.00 NIST
Inp 1228.00 NIST
Tboil 496.70 K NIST
Tc 713.85 K Relay (1.0) Calculated Property
Tfus 292.24 K Relay (1.0) Calculated Property
Vc 0.460 m3/kmol Relay (1.0) Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [157.66; 367.31] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A2.29100e+00
Coefficient B6.67740e-01
Coefficient C-3.83320e-04
Coefficient D8.06000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 157.66 J/mol×K 273.00 Calculated Property
Cp,gas 194.12 J/mol×K 353.78 Calculated Property
Cp,gas 226.69 J/mol×K 434.56 Calculated Property
Cp,gas 255.63 J/mol×K 515.33 Calculated Property
Cp,gas 281.20 J/mol×K 596.11 Calculated Property
Cp,gas 303.64 J/mol×K 676.89 Calculated Property
Cp,gas 323.22 J/mol×K 757.67 Calculated Property
Cp,gas 340.19 J/mol×K 838.44 Calculated Property
Cp,gas 354.80 J/mol×K 919.22 Calculated Property
Cp,gas 367.31 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0017313; 0.0002259] Pa×s [272.57; 487.20] Joback Predicted correlation Show Hide
EquationY = exp(A + B/T + C·ln(T) + D·T^E)
Y is η in Pa×s, T in K
Coefficient A-1.09819e+01
Coefficient B1.26010e+03
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
CommentLiquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.272.57
Temperature range, max.487.20
η 0.0017313 Pa×s 272.57 Calculated Property
η 0.0011936 Pa×s 296.42 Calculated Property
η 0.0008697 Pa×s 320.26 Calculated Property
η 0.0006622 Pa×s 344.11 Calculated Property
η 0.0005223 Pa×s 367.96 Calculated Property
η 0.0004240 Pa×s 391.81 Calculated Property
η 0.0003526 Pa×s 415.65 Calculated Property
η 0.0002991 Pa×s 439.50 Calculated Property
η 0.0002581 Pa×s 463.35 Calculated Property
η 0.0002259 Pa×s 487.20 Calculated Property
Property Value Unit Temperature (K) Source
Pvap [1.33; 202.65] kPa [367.32; 529.03] The Yaws Handbook of Vapor Pressure Show Hide
Equationln(Y) = A + B/(T + C)
Y is Pvap in kPa, T in K
Coefficient A1.42619e+01
Coefficient B-4.02603e+03
Coefficient C-7.92190e+01
Temperature range, min.367.32
Temperature range, max.529.03
Pvap 1.33 kPa 367.32 Calculated Property
Pvap 3.03 kPa 385.29 Calculated Property
Pvap 6.28 kPa 403.26 Calculated Property
Pvap 12.06 kPa 421.22 Calculated Property
Pvap 21.71 kPa 439.19 Calculated Property
Pvap 36.94 kPa 457.16 Calculated Property
Pvap 59.91 kPa 475.13 Calculated Property
Pvap 93.16 kPa 493.09 Calculated Property
Pvap 139.64 kPa 511.06 Calculated Property
Pvap 202.65 kPa 529.03 Calculated Property

Similar Compounds

2,4-DI[CHLOROMETHYL]TOLUENE. Benzene, 1,4-bis(chloromethyl)-2-methyl-. Benzene, 1,2-bis-(chloromethyl)-4-methyl. BENZENE, 1-(CHLOROMETHYL)-2,4-DIMETHYL-. Benzene, 1,2,4-tris-(chloromethyl). 1,2,4-trimethyl-6-(chloromethyl)benzene. Benzene, 4-(chloromethyl)-1,2-dimethyl-. 1,4-Dimethyl-2,6-bis(chloromethyl)benzene. 1,2-Dimethyl-3,5-bis(chloromethyl)benzene. 1,2,4-Trimethyl-3-(chloromethyl)benzene. Benzene, 1-(chloromethyl)-2,3-dimethyl. 1,2,3-Trimethyl-4-(chloromethyl)benzene. 1,2-Dimethyl-3,4-bis(chloromethyl)benzene. 1,2-Dimethyl-3,6-bis(chloromethyl)benzene. Benzene, 1-(chloromethyl)-2,4,5-trimethyl-.

Find more compounds similar to 2,5-Dimethylbenzyl chloride.

Sources

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