1,2-Cyclohexanedicarboxylic acid, 4-methyl-

Base Information

• Chemical Name: 1,2-Cyclohexanedicarboxylic acid, 4-methyl-
• CAS No.: 57567-84-7
• Molecular Formula: C9H14O4
• Molecular Weight: 186.208
• Hs Code.: 2917209090
• DSSTox Substance ID: DTXSID50875821
• Nikkaji Number: J169.071J
• Mol file: 57567-84-7.mol

Synonyms:methylhexahydrophthalic acid;MHHP acid

Chemical Property of 1,2-Cyclohexanedicarboxylic acid, 4-methyl-

Chemical Property:

• Vapor Pressure: 9.14E-07mmHg at 25°C
• Melting Point: 165 °C
• Boiling Point: 378.2°Cat760mmHg
• PKA: 4.28±0.31(Predicted)
• Flash Point: 196.7°C
• PSA: 74.60000
• Density: 1.233g/cm³
• LogP: 1.20800
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 186.08920892
• Heavy Atom Count: 13
• Complexity: 224

Purity/Quality:

99% ^*data from raw suppliers

HEXAHYDRO-4-METHYLPHTHALIC ACID Aldrich ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC1CCC(C(C1)C(=O)O)C(=O)O

Technology Process of 1,2-Cyclohexanedicarboxylic acid, 4-methyl-

There total 12 articles about 1,2-Cyclohexanedicarboxylic acid, 4-methyl- which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

(+/-)-4t-methyl-cyclohexane-1r,2c-dicarboxylic acid-anhydride (19438-60-9,52020-34-5,52020-35-6,58864-31-6) → (+/-)-4t-methyl-cyclohexane-1r,2c-dicarboxylic acid (57567-84-7,104320-26-5,104370-98-1,106622-73-5,106622-74-6)

Guidance literature:

With water;

DOI:10.1021/ja01160a070

Reference yield:

(+/-)-4c-methyl-cyclohexane-1r,2c-dicarboxylic acid-anhydride (19438-60-9,52020-34-5,52020-35-6,58864-31-6) → (+/-)-4c-methyl-cyclohexane-1r,2c-dicarboxylic acid (57567-84-7,104320-26-5,104370-98-1,106622-73-5,106622-74-6)

Guidance literature:

With water;

DOI:10.1021/ja01160a070

Reference yield:

→ (+/-)-4t-methyl-cyclohexane-1r,2c-dicarboxylic acid (57567-84-7,104320-26-5,104370-98-1,106622-73-5,106622-74-6)

Guidance literature:

With nickel; ethyl acetate; Hydrogenation;

DOI:10.1021/ja01164a113

upstream raw materials:

(+/-)-4c-methyl-cyclohexane-1r,2t-dicarboxylic acid-anhydride

water

(+/-)-4c-methyl-cyclohexane-1r,2t-dicarboxylic acid

(+/-)-4c-methyl-cyclohexane-1r,2t-dicarboxylic acid dimethyl ester

Downstream raw materials:

(+/-)-4t-methyl-cyclohexane-1r,2t-dicarboxylic acid

(+/-)-4t-methyl-cyclohexane-1r,2t-dicarboxylic acid-anhydride

(+/-)-4t-methyl-cyclohexane-1r,2c-dicarboxylic acid-anhydride

(+/-)-4c-methyl-cyclohexane-1r,2c-dicarboxylic acid dimethyl ester