Cas no 15941-50-1 (4-Cyclohexene-1,2-dicarboxylic acid, 3-methyl-)
15941-50-1 structure
Product Name:4-Cyclohexene-1,2-dicarboxylic acid, 3-methyl-
CAS No:15941-50-1
MF:C9H12O4
MW:184.189183235168
CID:96398
Update Time:2024-01-24
4-Cyclohexene-1,2-dicarboxylic acid, 3-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 4-Cyclohexene-1,2-dicarboxylic acid, 3-methyl-
- c-3-methyl-4-ene-r-1,c-2-cyclohexenedicarboxylic acid
-
- MDL： MFCD00037157
- Inchi： 1S/C9H12O4/c1-5-3-2-4-6(8(10)11)7(5)9(12)13/h2-3,5-7H,4H2,1H3,(H,10,11)(H,12,13)
- InChI Key： ZPRXNOLDOXHXIQ-UHFFFAOYSA-N
- SMILES： C1(C(O)=O)CC=CC(C)C1C(O)=O
Computed Properties
- Exact Mass: 184.07356
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
Experimental Properties
- Density: 1.1966 g/cm3(Temp: 25 °C)
- Melting Point: 154 °C
- Boiling Point: 119 °C(Press: 2 Torr)
- PSA: 74.6
- pka: 4.30±0.60(Predicted)
4-Cyclohexene-1,2-dicarboxylic acid, 3-methyl- Related Literature
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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3. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
15941-50-1 (4-Cyclohexene-1,2-dicarboxylic acid, 3-methyl-) Related Products
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