322377

Hexamethylbenzene

99%

Manufacturer: Sigma Aldrich

CAS Number: 87-85-4

Synonym(S): 1,2,3,4,5,6-Hexamethylbenzene, Mellitene

Select a Size

Pack Size SKU Availability Price
1 G 322377-1-G In Stock ₹ 6,288.30
5 G 322377-5-G In Stock ₹ 8,836.50

322377 - 1 G

₹ 6,288.30

In Stock

Quantity

1

Base Price: ₹ 6,288.30

GST (18%): ₹ 1,131.894

Total Price: ₹ 7,420.194

Quality Level

100

Assay

99%

bp

264 °C (lit.)

mp

164-166 °C (lit.)

SMILES string

Cc1c(C)c(C)c(C)c(C)c1C

InChI

1S/C12H18/c1-7-8(2)10(4)12(6)11(5)9(7)3/h1-6H3

InChI key

YUWFEBAXEOLKSG-UHFFFAOYSA-N

Other Options

Image Product Name Manufacturer Price Range
50-214-8782
eMolecules​ Hexamethylbenzene | 87-85-4 | MFCD00008523 | 1g
eMolecules​ ₹ 3,292.35
CS-0095851
Hexamethylbenzene
ChemScene ₹ 1,197.84 - ₹ 56,384.04
AB74639
87-85-4 | Hexamethylbenzene
A2B Chem ₹ 855.60 - ₹ 15,058.56

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Description

  • Application: Ru(II)-Arene Complexes of Curcumin and Bisdesmethoxycurcumin Metabolites: Investigates the structure and reactivity of Ru(II)-arene complexes with curcumin metabolites, shedding light on potential applications in drug development and synthesis pathways involving hexamethylbenzene derivatives (Dyson et al., 2024). Theoretical study on degradation of polymethyl substituted benzenes by OH radicals in the atmosphere: Offers a comprehensive computational analysis on the atmospheric reactions of polymethyl substituted benzenes, including hexamethylbenzene, with OH radicals, relevant for understanding their environmental impacts (Zhao et al., 2024). Revisiting the bonding of the pentagonal-pyramidal C(6)H(6)(2+) and C(6)(CH(3))(6)(2+) dications: Explores the unique bonding and structural characteristics of hexamethylbenzene in dicationic forms, providing insights into its chemical behavior under various electronic conditions (Torres et al., 2023). Naphthalene Diimide-Functionalized Half-Sandwich Ru(II) Complexes as Mitochondria-Targeted Anticancer and Antimetastatic Agents: Discusses the synthesis and biological evaluation of Ru(II) complexes involving hexamethylbenzene structures, aimed at developing new therapeutic agents (Yang et al., 2023). Comparative Study on Carbon Erosion of Nickel Alloys in the Presence of Organic Compounds under Various Reaction Conditions: Examines the impact of organic compounds, including hexamethylbenzene, on the wear and corrosion of nickel alloys, relevant for industrial applications (Volodin et al., 2022).

SAFETY INFORMATION

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Compare Similar Items

Show Difference

Img

Sigma Aldrich

322377

99%...


Quality Level:
100

Assay:
99%

bp:
264 °C (lit.)

mp:
164-166 °C (lit.)

SMILES string:
Cc1c(C)c(C)c(C)c(C)c1C

InChI:
1S/C12H18/c1-7-8(2)10(4)12(6)11(5)9(7)3/h1-6H3

InChI key:
YUWFEBAXEOLKSG-UHFFFAOYSA-N

Img

Sigma Aldrich

322385

99.99% trace metals basis...


Quality Level:
100

Assay:
99.99% trace metals basis

bp:
__

mp:
__

SMILES string:
N.N.N.N.N.N.N.N.N.N.O[W]12(=O)O[W]3(O)(=O)O[W](O)(=O)(O3)O[W]4(O)(=O)O[W](O)(=O)(O4)O[W]5(O)(=O)O[W]6(=O)(O5)O[W]7(=O)(O[W](O)(=O)(O[W]8(O)(=O)O[W](O)(=O)(O[W](O)(=O)(O1)O2)O8)O7)O6

InChI:
1S/10H3N.10H2O.31O.12W/h10*1H3;10*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;10*+1/p-10

InChI key:
LMAJGSPZJYEENT-UHFFFAOYSA-D

Img

Sigma Aldrich

322385

99.99% trace metals basis...


Quality Level:
100

Assay:
99.99% trace metals basis

bp:
__

mp:
__

SMILES string:
N.N.N.N.N.N.N.N.N.N.O[W]12(=O)O[W]3(O)(=O)O[W](O)(=O)(O3)O[W]4(O)(=O)O[W](O)(=O)(O4)O[W]5(O)(=O)O[W]6(=O)(O5)O[W]7(=O)(O[W](O)(=O)(O[W]8(O)(=O)O[W](O)(=O)(O[W](O)(=O)(O1)O2)O8)O7)O6

InChI:
1S/10H3N.10H2O.31O.12W/h10*1H3;10*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;10*+1/p-10

InChI key:
LMAJGSPZJYEENT-UHFFFAOYSA-D

Img

Sigma Aldrich

322393

98%...


Quality Level:
100

Assay:
98%

bp:
49 °C/0.27 mmHg (lit.)

mp:
__

SMILES string:
COc1ccc(OC(Cl)=O)cc1

InChI:
1S/C8H7ClO3/c1-11-6-2-4-7(5-3-6)12-8(9)10/h2-5H,1H3

InChI key:
CCFSGQKTSBIIHG-UHFFFAOYSA-N