Cas no 23276-77-9 (1,2-Benzenedicarboxylicacid, 1-(1-ethylhexyl) ester)
23276-77-9 structure
Product Name:1,2-Benzenedicarboxylicacid, 1-(1-ethylhexyl) ester
CAS No:23276-77-9
MF:C16H22O4
MW:278.343485355377
CID:259073
PubChem ID:90900
Update Time:2025-04-19
1,2-Benzenedicarboxylicacid, 1-(1-ethylhexyl) ester Chemical and Physical Properties
Names and Identifiers
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- 1,2-Benzenedicarboxylicacid, 1-(1-ethylhexyl) ester
- 2-octan-3-yloxycarbonylbenzoic acid
- (1-Ethylhexyl) hydrogen phthalate
- 1,2-Benzenedicarboxylic acid, mono(1-ethylhexyl) ester
- 2-[(octan-3-yloxy)carbonyl]benzoic acid
- Mono(1-ethylhexyl) phthalate
- Phthalic acid, mono(1-ethylhexyl) ester
- 1,2-benzenedicarboxylic acid mono(ethylhexyl) ester
- 23276-77-9
- DTXSID80945960
- NS00051384
- EINECS 245-547-8
- 2-{[(Octan-3-yl)oxy]carbonyl}benzoic acid
- SCHEMBL1523178
-
- Inchi： 1S/C16H22O4/c1-3-5-6-9-12(4-2)20-16(19)14-11-8-7-10-13(14)15(17)18/h7-8,10-12H,3-6,9H2,1-2H3,(H,17,18)
- InChI Key： SVRGUNPFMROZBU-UHFFFAOYSA-N
- SMILES： O(C(C1C=CC=CC=1C(=O)O)=O)C(CC)CCCCC
Computed Properties
- Exact Mass: 278.15186
- Monoisotopic Mass: 278.152
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 20
- Rotatable Bond Count: 9
- Complexity: 314
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.4
- Topological Polar Surface Area: 63.6?2
Experimental Properties
- Density: 1.088
- Boiling Point: 408.9°Cat760mmHg
- Flash Point: 144.1°C
- Refractive Index: 1.516
- PSA: 63.6
1,2-Benzenedicarboxylicacid, 1-(1-ethylhexyl) ester Related Literature
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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2. An amorphous lanthanum–iridium solid solution with an open structure for efficient water splitting?Wei Sun,Chenglong Ma,Xinlong Tian,Jianjun Liao,Ji Yang,Chengjun Ge,Weiwei Huang J. Mater. Chem. A, 2020,8, 12518-12525
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
23276-77-9 (1,2-Benzenedicarboxylicacid, 1-(1-ethylhexyl) ester) Related Products
- 84-74-2(Dibutyl phthalate)
- 3319-31-1(Trioctyl Trimellitate)
- 84-75-3(Di-n-hexyl Phthalate)
- 84-77-5(Didecyl Phthalate (~90%))
- 131-18-0(1,2-dipentyl benzene-1,2-dicarboxylate)
- 84-61-7(Dicyclohexyl phthalate)
- 84-76-4(Dinonyl phthalate)
- 117-84-0(1,2-dioctyl benzene-1,2-dicarboxylate)
- 117-81-7(Bis(2-ethylhexyl) phthalate)
- 85-68-7(Benzyl butyl phthalate)
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