Cas no 4936-94-1 (Benzophenone,3,3',5,5'-tetrachloro-2,2'-dihydroxy- (6CI,7CI,8CI))
4936-94-1 structure
Product Name:Benzophenone,3,3',5,5'-tetrachloro-2,2'-dihydroxy- (6CI,7CI,8CI)
CAS No:4936-94-1
MF:C13H6Cl4O3
MW:351.996940135956
CID:333730
PubChem ID:351855
Update Time:2025-04-19
Benzophenone,3,3',5,5'-tetrachloro-2,2'-dihydroxy- (6CI,7CI,8CI) Chemical and Physical Properties
Names and Identifiers
-
- Benzophenone,3,3',5,5'-tetrachloro-2,2'-dihydroxy- (6CI,7CI,8CI)
- bis(3,5-dichloro-2-hydroxyphenyl)methanone
- 3,5,3',5'-Tetrachlor-2,2'-dihydroxy-benzophenon
- 3,5,3',5'-tetrachloro-2,2'-dihydroxy-benzophenone
- AC1L6Z7H
- AG-F-65517
- BIS(3,5-DICHLORO-2-HYDROXY-PHENYL)METHANONE
- CTK4J1267
- NSC523876
- DTXSID40326079
- 4936-94-1
- NSC-523876
-
- Inchi： 1S/C13H6Cl4O3/c14-5-1-7(12(19)9(16)3-5)11(18)8-2-6(15)4-10(17)13(8)20/h1-4,19-20H
- InChI Key： HLCPIUUTMSRQOP-UHFFFAOYSA-N
- SMILES： ClC1=CC(=CC(=C1O)C(C1C=C(C=C(C=1O)Cl)Cl)=O)Cl
Computed Properties
- Exact Mass: 349.90728
- Monoisotopic Mass: 349.907105g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 336
- 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: 5.6
- Topological Polar Surface Area: 57.5?2
Experimental Properties
- PSA: 57.53
- LogP: 4.94240
Benzophenone,3,3',5,5'-tetrachloro-2,2'-dihydroxy- (6CI,7CI,8CI) 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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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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