Cas no 87277-06-3 (2-Chloro-3-hydroxy-4-methoxybenzoic acid)
87277-06-3 structure
Product Name:2-Chloro-3-hydroxy-4-methoxybenzoic acid
CAS No:87277-06-3
MF:C8H7ClO4
MW:202.59178185463
CID:2654709
PubChem ID:18466876
Update Time:2025-04-21
2-Chloro-3-hydroxy-4-methoxybenzoic acid Chemical and Physical Properties
Names and Identifiers
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- 2-chloro-3-hydroxy-4-methoxybenzoic acid
- SCHEMBL7691123
- DTXSID30594124
- 87277-06-3
- 2-Chloro-3-hydroxy-4-methoxybenzoic acid
-
- Inchi： 1S/C8H7ClO4/c1-13-5-3-2-4(8(11)12)6(9)7(5)10/h2-3,10H,1H3,(H,11,12)
- InChI Key： QVZPIEIMRVXFFE-UHFFFAOYSA-N
- SMILES： ClC1C(=C(C=CC=1C(=O)O)OC)O
Computed Properties
- Exact Mass: 202.0032864g/mol
- Monoisotopic Mass: 202.0032864g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 197
- 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
- Topological Polar Surface Area: 66.8?2
2-Chloro-3-hydroxy-4-methoxybenzoic acid Related Literature
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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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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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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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Alena Koukalová,?árka Pokorná,Aimee L. Boyle,Nestor Lopez Mora,Alexander Kros,Martin Hof,Radek ?achl Nanoscale, 2018,10, 19064-19073
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