Cas no 52005-46-6 (1,3-Isobenzofurandione,dichloro- (9CI))
52005-46-6 structure
Product Name:1,3-Isobenzofurandione,dichloro- (9CI)
CAS No:52005-46-6
MF:C8H2Cl2O3
MW:217.005680561066
CID:377570
PubChem ID:3016714
Update Time:2025-04-19
1,3-Isobenzofurandione,dichloro- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Isobenzofurandione,dichloro- (9CI)
- 4,5-dichloro-2-benzofuran-1,3-dione
- dichlorophthalic anhydride
- EINECS 257-594-1
- NS00032400
- 52005-46-6
- CHEMBL2270553
- SCHEMBL855450
- FT-0759024
- NSC 6305
-
- Inchi： 1S/C8H2Cl2O3/c9-4-2-1-3-5(6(4)10)8(12)13-7(3)11/h1-2H
- InChI Key： GAIPRQZXSYSCRD-UHFFFAOYSA-N
- SMILES： ClC1=C(C=CC2C(=O)OC(C=21)=O)Cl
Computed Properties
- Exact Mass: 215.93816
- Monoisotopic Mass: 215.938
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 266
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 2.5
- Topological Polar Surface Area: 43.4?2
Experimental Properties
- Density: 1.715
- Boiling Point: 328.8°Cat760mmHg
- Flash Point: 153.6°C
- Refractive Index: 1.638
- PSA: 43.37
- LogP: 0.99720
1,3-Isobenzofurandione,dichloro- (9CI) Related Literature
-
Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
-
Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
-
Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
-
M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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