5-Methyl-1,3-benzenediacetonitrile

Modify Date: 2025-08-25 13:11:26

5-Methyl-1,3-benzenediacetonitrile Structure
5-Methyl-1,3-benzenediacetonitrile structure
 Common Name 5-Methyl-1,3-benzenediacetonitrile
CAS Number 120511-74-2 Molecular Weight 170.210
Density 1.1±0.1 g/cm3 Boiling Point 342.0±32.0 °C at 760 mmHg
Molecular Formula C11H10N2 Melting Point 71-72°C
MSDS N/A Flash Point 164.5±19.0 °C

 Names

Name 5-Methyl-1,3-benzenediacetonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.1±0.1 g/cm3
Boiling Point 342.0±32.0 °C at 760 mmHg
Melting Point 71-72°C
Molecular Formula C11H10N2
Molecular Weight 170.210
Flash Point 164.5±19.0 °C
Exact Mass 170.084396
PSA 47.58000
LogP 1.14
Vapour Pressure 0.0±0.7 mmHg at 25°C
Index of Refraction 1.545
InChIKey XJCXEUYJQHPEAE-UHFFFAOYSA-N
SMILES Cc1cc(CC#N)cc(CC#N)c1
Storage condition Refrigerator

 Safety Information

HS Code 2926909090

 Synthetic Route

3,5-Bis(bromomethyl)toluene structure

3,5-Bis(bromome...

CAS#:19294-04-3

Sodium cyanide structure

Sodium cyanide

CAS#:143-33-9

~91%

5-Methyl-1,3-benzenediacetonitrile Structure

5-Methyl-1,3-be...

CAS#:120511-74-2

Literature: US2006/189670 A1, ; Page/Page column 5-6 ;
3,5-Bis(bromomethyl)toluene structure

3,5-Bis(bromome...

CAS#:19294-04-3

~%

5-Methyl-1,3-benzenediacetonitrile Structure

5-Methyl-1,3-be...

CAS#:120511-74-2

Literature: US4935437 A1, ; US 4935437 A
3,5-Bis(bromomethyl)toluene structure

3,5-Bis(bromome...

CAS#:19294-04-3

POTASSIUM CYANIDE structure

POTASSIUM CYANIDE

CAS#:151-50-8

~92%

5-Methyl-1,3-benzenediacetonitrile Structure

5-Methyl-1,3-be...

CAS#:120511-74-2

Literature: Organic and Biomolecular Chemistry, , vol. 5, # 18 p. 2940 - 2952
POTASSIUM CYANIDE structure

POTASSIUM CYANIDE

CAS#:151-50-8

~%

5-Methyl-1,3-benzenediacetonitrile Structure

5-Methyl-1,3-be...

CAS#:120511-74-2

Literature: Chemische Berichte, , vol. 58, p. 283
3,5-Bis(bromomethyl)toluene structure

3,5-Bis(bromome...

CAS#:19294-04-3

Ethanol structure

Ethanol

CAS#:64-17-5

POTASSIUM CYANIDE structure

POTASSIUM CYANIDE

CAS#:151-50-8

~%

5-Methyl-1,3-benzenediacetonitrile Structure

5-Methyl-1,3-be...

CAS#:120511-74-2

Literature: Chemische Berichte, , vol. 58, p. 283

 Customs

HS Code 2926909090
Summary HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 Synonyms

5-METHYL-1,3-DIACETONITRILBENZENE
2,2'-(5-Methylbenzol-1,3-diyl)diacetonitril
1,3-Benzenediacetonitrile,5-methyl
1,3-Benzenediacetonitrile, 5-methyl-
Intermediateofanastrozole
5-Methyl-1,3-benzenediacetonitrile
5-Methyl-1,3-dicyanobenzene
1-METHYL-3,5 BENZENE DIACETONITRILE
MFCD07782113
2,2'-(5-methylbenzene-1,3-diyl)diacetonitrile
5-Methyl-1,3-diacetonitrilbezene
5-METHYL-1,3-DIACETONITRILOBENZENE
2,2'-(5-Methyl-1,3-phenylene)diacetonitrile
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