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1585-16-6

Basic Information
CAS No.: 1585-16-6
Name: alpha-2-Chloroisodurene
Article Data: 34
Molecular Structure:
Molecular Structure of 1585-16-6 (alpha-2-Chloroisodurene)
Formula: C10H13Cl
Molecular Weight: 168.666
Synonyms: (Chloromethyl)mesitylene;1,3,5-Trimethyl-2-(chloromethyl)benzene;1-Chloromethyl-2,4,6-trimethylbenzene;2,4,6-Trimethylbenzyl chloride;Mesitylmethyl chloride;NSC 405484;o,o,p-Trimethylbenzyl chloride;a-Chloroisodurene;
EINECS: 216-440-3
Density: 1.016 g/cm3
Melting Point: 87-89 °C(lit.)
Boiling Point: 244.6 °C at 760 mmHg
Flash Point: 106.1 °C
Appearance: white to light yellow crystal powder
Hazard Symbols: CorrosiveC
Risk Codes: 34-20/21/22
Safety: 26-27-28-36/37/39-45-23
Transport Information: UN 3261 8/PG 2
PSA: 0.00000
LogP: 3.35060
Synthetic route
4170-90-5

2,4,6-trimethylbenzyl alcohol

1585-16-6

2-chloromethyl-1,3,5-trimethylbenzene

Conditions
ConditionsYield
With thionyl chloride In dichloromethane at 0 - 20℃; for 1h;100%
With oxalyl dichloride In dichloromethane at 20℃; Appel Halogenation; Reflux;98%
With tetrachloromethane; ring-opening metathesis polymer-supported triphenylphosphine In dichloromethane at 45℃; for 6h;89%
50-00-0

formaldehyd

108-67-8

1,3,5-trimethyl-benzene

1585-16-6

2-chloromethyl-1,3,5-trimethylbenzene

Conditions
ConditionsYield
With hydrogenchloride In water at 65 - 75℃;90%
With hydrogenchloride; acetic acid In water at 37℃; for 1.5h;68%
With hydrogenchloride In water at 60 - 70℃; for 7h;36%
4170-90-5

2,4,6-trimethylbenzyl alcohol

98-88-4

benzoyl chloride

A

(2,4,6-trimethylphenyl)methyl benzoate

B

1585-16-6

2-chloromethyl-1,3,5-trimethylbenzene

Conditions
ConditionsYield
With 1-methylsulfinyl-2-methoxybenzene In acetonitrile at 20℃; for 14h; Sealed tube;A n/a
B 74%
7093-91-6

chloromethyl isocyanate

108-67-8

1,3,5-trimethyl-benzene

A

1585-16-6

2-chloromethyl-1,3,5-trimethylbenzene

B

92277-70-8

2-Isocyanatomethyl-1,3,5-trimethyl-benzene

Conditions
ConditionsYield
With iron(III) chloride 1.) 40 - 60 deg C, 2.) 100 - 150 deg C, 2 h;A 15%
B 32%
107-30-2

chloromethyl methyl ether

64-19-7

acetic acid

108-67-8

1,3,5-trimethyl-benzene

1585-16-6

2-chloromethyl-1,3,5-trimethylbenzene

Conditions
ConditionsYield
at 65℃; ohne Katalysator; Geschwindigkeit dieser Reaktion und der analogen Reaktionen mit anderen aromatischen Kohlenwasserstoffen bei 65grad und 100grad;
107-30-2

chloromethyl methyl ether

64-19-7

acetic acid

108-67-8

1,3,5-trimethyl-benzene

A

1585-17-7

2,4-bis(chloromethyl)mesitylene

B

1585-16-6

2-chloromethyl-1,3,5-trimethylbenzene

Conditions
ConditionsYield
at 80℃;
107-30-2

chloromethyl methyl ether

108-67-8

1,3,5-trimethyl-benzene

1585-16-6

2-chloromethyl-1,3,5-trimethylbenzene

Conditions
ConditionsYield
With acetic acid at 65 - 80℃;
107-30-2

chloromethyl methyl ether

108-67-8

1,3,5-trimethyl-benzene

A

1585-17-7

2,4-bis(chloromethyl)mesitylene

B

1585-16-6

2-chloromethyl-1,3,5-trimethylbenzene

3188-13-4

ethyl chloromethyl ether

108-67-8

1,3,5-trimethyl-benzene

1585-16-6

2-chloromethyl-1,3,5-trimethylbenzene

Conditions
ConditionsYield
With carbon disulfide; tin(IV) chloride
With tetrachloromethane; tin(IV) chloride at -5℃;
With acetic acid
50-00-0

formaldehyd

108-67-8

1,3,5-trimethyl-benzene

A

1585-17-7

2,4-bis(chloromethyl)mesitylene

B

1585-16-6

2-chloromethyl-1,3,5-trimethylbenzene

Conditions
ConditionsYield
With hydrogenchloride at 65℃; Einleiten von HCl;
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Chemistry

IUPAC Name: 2-(Chloromethyl)-1,3,5-trimethylbenzene
Synonyms of Benzene,2-(chloromethyl)-1,3,5-trimethyl- (CAS NO.1585-16-6): AI3-15521 ; EINECS 216-440-3 ; 2,4,6-Trimethylbenzyl chloride
CAS NO: 1585-16-6
Molecular Formula: C10H13Cl
Molecular Weight: 168.6632
Molecular Structure:

Melting Point: 87-89 °C
Product Categories: Miscellaneous ; Aromatics Compounds ; Aromatics 
Freely Rotating Bonds: 1 
Index of Refraction: 1.52
Molar Refractivity: 50.49 cm3
Molar Volume: 165.9 cm3
Surface Tension: 32.2 dyne/cm
Density of Benzene,2-(chloromethyl)-1,3,5-trimethyl- (CAS NO.1585-16-6): 1.016 g/cm3
Flash Point: 106.1 °C
Enthalpy of Vaporization: 46.22 kJ/mol
Boiling Point: 244.6 °C at 760 mmHg
Vapour Pressure: 0.047 mmHg at 25°C

Safety Profile

Hazard Codes of Benzene,2-(chloromethyl)-1,3,5-trimethyl- (CAS NO.1585-16-6): CorrosiveC
Risk Statements: 34-20/21/22 
R34: Causes burns. 
R20/21/22: Harmful by inhalation, in contact with skin and if swallowed.
Safety Statements: 26-27-28-36/37/39-45-23 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S27: Take off immediately all contaminated clothing. 
S28: After contact with skin, wash immediately with plenty of soap-suds. 
S36/37/39: Wear suitable protective clothing, gloves and eye/face protection. 
S45: In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.) 
S23: Do not breathe vapour.
RIDADR: UN 3261 8/PG 2
WGK Germany: 3
RTECS: DP1402000
HazardClass: 8
PackingGroup: II