Cas no 30800-69-2 (4-chloro-1-methoxy-benzo[g]phthalazine)
30800-69-2 structure
Product Name:4-chloro-1-methoxy-benzo[g]phthalazine
CAS No:30800-69-2
MF:C13H9ClN2O
MW:244.67636179924
CID:1444278
PubChem ID:24944448
Update Time:2025-04-20
4-chloro-1-methoxy-benzo[g]phthalazine Chemical and Physical Properties
Names and Identifiers
-
- 4-chloro-1-methoxy-benzo[g]phthalazine
- LogP
- 4-chloro-1-methoxybenzo[g]phthalazine
- 1-Chloro-4-methoxybenzo[g]phthalazine
- DTXSID90648036
- 30800-69-2
-
- Inchi: 1S/C13H9ClN2O/c1-17-13-11-7-9-5-3-2-4-8(9)6-10(11)12(14)15-16-13/h2-7H,1H3
- InChI Key: BEACXLQHWXXPBY-UHFFFAOYSA-N
- SMILES: ClC1=C2C=C3C=CC=CC3=CC2=C(N=N1)OC
Computed Properties
- Exact Mass: 244.04047
- Monoisotopic Mass: 244.0403406g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 1
- Complexity: 276
- 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: 3.3
- Topological Polar Surface Area: 35?2
Experimental Properties
- PSA: 35.01
4-chloro-1-methoxy-benzo[g]phthalazine Related Literature
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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