Cas no 119735-20-5 (Benzoyl chloride,3-chloro-4,5-dihydroxy-)
119735-20-5 structure
Product Name:Benzoyl chloride,3-chloro-4,5-dihydroxy-
CAS No:119735-20-5
MF:C7H4Cl2O3
MW:207.010860443115
CID:132258
PubChem ID:15173602
Update Time:2025-04-19
Benzoyl chloride,3-chloro-4,5-dihydroxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzoyl chloride,3-chloro-4,5-dihydroxy-
- 3-chloro-4,5-dihydroxybenzoyl chloride
- Benzoyl chloride, 3-chloro-4,5-dihydroxy- (9CI)
- DTXSID40569540
- 119735-20-5
-
- Inchi： 1S/C7H4Cl2O3/c8-4-1-3(7(9)12)2-5(10)6(4)11/h1-2,10-11H
- InChI Key： AXPHXKHORNGRIK-UHFFFAOYSA-N
- SMILES： ClC1=CC(C(=O)Cl)=CC(=C1O)O
Computed Properties
- Exact Mass: 205.95382
- Monoisotopic Mass: 205.9537494g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 186
- 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: 2.7
- Topological Polar Surface Area: 57.5?2
Experimental Properties
- PSA: 57.53
Benzoyl chloride,3-chloro-4,5-dihydroxy- Related Literature
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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