Cas no 85391-48-6 (1,2-Benzenedicarboxylicacid, 1,2-bis(2,5-dimethylheptyl) ester)
85391-48-6 structure
Product Name:1,2-Benzenedicarboxylicacid, 1,2-bis(2,5-dimethylheptyl) ester
CAS No:85391-48-6
MF:C26H42O4
MW:418.609288692474
CID:721706
PubChem ID:3020638
Update Time:2024-03-01
1,2-Benzenedicarboxylicacid, 1,2-bis(2,5-dimethylheptyl) ester Chemical and Physical Properties
Names and Identifiers
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- 1,2-Benzenedicarboxylicacid, 1,2-bis(2,5-dimethylheptyl) ester
- bis(2,5-dimethylheptyl) benzene-1,2-dicarboxylate
- bis(2,5-dimethylheptyl) phthalate
- Bis(2,5-dimethylheptyl)phthalat
- 1,2-Benzenedicarboxylic acid bis(2,5-dimethylheptyl) ester
- Einecs 286-802-3
- 1,2-Benzenedicarboxylic acid, 1,2-bis(2,5-dimethylheptyl) ester
-
- Inchi： 1S/C26H42O4/c1-7-19(3)13-15-21(5)17-29-25(27)23-11-9-10-12-24(23)26(28)30-18-22(6)16-14-20(4)8-2/h9-12,19-22H,7-8,13-18H2,1-6H3
- InChI Key： ABJMNVCTWJQTJZ-UHFFFAOYSA-N
- SMILES： C1(C(OCC(C)CCC(C)CC)=O)=CC=CC=C1C(OCC(C)CCC(C)CC)=O
Computed Properties
- Exact Mass: 418.308
- Monoisotopic Mass: 418.308
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 30
- Rotatable Bond Count: 16
- Complexity: 445
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 4
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 52.6?2
- XLogP3: 8.6
Experimental Properties
- Density: 0.971
- Boiling Point: 377.4°C at 760 mmHg
- Flash Point: 200.3°C
- Refractive Index: 1.486
1,2-Benzenedicarboxylicacid, 1,2-bis(2,5-dimethylheptyl) ester Related Literature
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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5. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
85391-48-6 (1,2-Benzenedicarboxylicacid, 1,2-bis(2,5-dimethylheptyl) ester) Related Products
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- 131-18-0(1,2-dipentyl benzene-1,2-dicarboxylate)
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- 6422-86-2(Dioctyl Terepthalate)
- 27554-26-3(Diisooctyl phthalate)
- 117-81-7(Bis(2-ethylhexyl) phthalate)
- 85-68-7(Benzyl butyl phthalate)
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