Cas no 752242-26-5 (5-Hydroxy-3-isopropoxybenzoic acid)
752242-26-5 structure
Product Name:5-Hydroxy-3-isopropoxybenzoic acid
CAS No:752242-26-5
MF:C10H12O4
MW:196.199883460999
CID:2191343
Update Time:2023-08-07
5-Hydroxy-3-isopropoxybenzoic acid Chemical and Physical Properties
Names and Identifiers
-
- Methyl 3-hydroxy-5-isopropoxybenzoate
- ZJJAKCGVBPXFQM-UHFFFAOYSA-N
- 5-hydroxy-3-isopropoxybenzoic acid
- 3-hydroxy-5-isopropoxy-benzoic acid
- MB22896
- Benzoic acid, 3-hydroxy-5-(1-methylethoxy)-
- 3-HYDROXY-5-(PROPAN-2-YLOXY)BENZOIC ACID
- 5-Hydroxy-3-isopropoxybenzoic acid
-
- Inchi： 1S/C10H12O4/c1-6(2)14-9-4-7(10(12)13)3-8(11)5-9/h3-6,11H,1-2H3,(H,12,13)
- InChI Key： ZJJAKCGVBPXFQM-UHFFFAOYSA-N
- SMILES： O(C1C=C(C=C(C(=O)O)C=1)O)C(C)C
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 202
- XLogP3: 2
- Topological Polar Surface Area: 66.8
5-Hydroxy-3-isopropoxybenzoic 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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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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