Cas no 25167-86-6 (1,2-Benzenediol,chloro-)
1,2-Benzenediol,chloro- structure
Product Name:1,2-Benzenediol,chloro-
CAS No:25167-86-6
MF:C6H7ClO2
MW:146.571581125259
CID:269572
PubChem ID:20026882
Update Time:2025-04-19
1,2-Benzenediol,chloro- Chemical and Physical Properties
Names and Identifiers
-
- 1,2-Benzenediol,chloro-
- 2-hydroxyphenyl hypochlorite
- Monochlorocatechol
- Pyrocatechol,chloro- (8CI)
- 25167-86-6
- Chloro-1,2-benzenediol
- 1,2-Benzenediol, chloro-
- NSC 7405
- SCHEMBL3362625
- pyrocatechol hydrochloride
-
- Inchi： 1S/C6H6O2.ClH/c7-5-3-1-2-4-6(5)8;/h1-4,7-8H;1H
- InChI Key： QHVYETYGDPODIT-UHFFFAOYSA-N
- SMILES： Cl.OC1C=CC=CC=1O
Computed Properties
- Exact Mass: 143.99785
- Monoisotopic Mass: 143.998
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 97.1
- 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: 1.9
- Topological Polar Surface Area: 40.5A^2
Experimental Properties
- Density: 1.471
- Melting Point: 49 °C
- Boiling Point: 138 °C / 20mmHg
- Flash Point: 97.1°C
- Refractive Index: 1.629
- PSA: 29.46
- LogP: 1.78730
1,2-Benzenediol,chloro- Related Literature
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
-
Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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