Cas no 18372-41-3 (1,2-Benzenediol, 4-(2-methylpropyl)-)
18372-41-3 structure
Product Name:1,2-Benzenediol, 4-(2-methylpropyl)-
CAS No:18372-41-3
MF:C10H14O2
MW:166.216963291168
CID:1377576
PubChem ID:14372665
Update Time:2025-04-20
1,2-Benzenediol, 4-(2-methylpropyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1,2-Benzenediol, 4-(2-methylpropyl)-
- DTXSID501297831
- 4-(2-Methylpropyl)-1,2-benzenediol
- 4-isobutylcatechol
- 18372-41-3
- 4-(2-methylpropyl)benzene-1,2-diol
- 4-iso-butylcatechol
- SCHEMBL57083
- KZFSBJHIZZZKDU-UHFFFAOYSA-N
-
- Inchi: 1S/C10H14O2/c1-7(2)5-8-3-4-9(11)10(12)6-8/h3-4,6-7,11-12H,5H2,1-2H3
- InChI Key: KZFSBJHIZZZKDU-UHFFFAOYSA-N
- SMILES: OC1=C(C=CC(=C1)CC(C)C)O
Computed Properties
- Exact Mass: 166.099379685g/mol
- Monoisotopic Mass: 166.099379685g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 134
- 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: 1.3
- Topological Polar Surface Area: 40.5?2
1,2-Benzenediol, 4-(2-methylpropyl)- Related Literature
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
18372-41-3 (1,2-Benzenediol, 4-(2-methylpropyl)-) Related Products
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