Cas no 62239-41-2 (Perylenetetracarboxylic acid)
Perylenetetracarboxylic acid structure
Product Name:Perylenetetracarboxylic acid
CAS No:62239-41-2
MF:C24H12O8
MW:428.34728717804
CID:452956
PubChem ID:19063515
Update Time:2025-04-19
Perylenetetracarboxylic acid Chemical and Physical Properties
Names and Identifiers
-
- Perylenetetracarboxylic acid
- perylene-1,2,3,4-tetracarboxylic acid
- 62239-41-2
- perylene tetracarboxylic
- WSRHMJYUEZHUCM-UHFFFAOYSA-N
- SCHEMBL186130
- DTXSID50597733
-
- Inchi： 1S/C24H12O8/c25-21(26)13-8-7-11-10-5-1-3-9-4-2-6-12(14(9)10)16-15(11)17(13)19(23(29)30)20(24(31)32)18(16)22(27)28/h1-8H,(H,25,26)(H,27,28)(H,29,30)(H,31,32)
- InChI Key： WSRHMJYUEZHUCM-UHFFFAOYSA-N
- SMILES： OC(C1C(C(=O)O)=C(C(=O)O)C2=C(C(=O)O)C=CC3C4=CC=CC5=CC=CC(=C45)C=1C=32)=O
Computed Properties
- Exact Mass: 428.05316
- Monoisotopic Mass: 428.05321734g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 32
- Rotatable Bond Count: 4
- Complexity: 838
- 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
- XLogP3: 3.9
- Topological Polar Surface Area: 149?2
Experimental Properties
- PSA: 149.2
Perylenetetracarboxylic acid Related Literature
-
Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
-
Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
-
A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
62239-41-2 (Perylenetetracarboxylic acid) Related Products
- 528-44-9(Trimellic Acid)
- 528-90-5(2,4,5-Trimethylbenzoic acid)
- 118-90-1(O-Toluic acid)
- 119-67-5(2-Carboxybenzaldehyde)
- 89-05-4(Pyromellitic acid)
- 86-55-5(1-Naphthoic acid)
- 128-97-2(Naphthalene-1,4,5,8-tetracarboxylic acid)
- 480-63-7(2,4,6-Trimethylbenzoic acid)
- 569-51-7(1,2,3-Benzenetricarboxylic acid)
- 88-99-3(Phthalic acid)
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