Cas no 623560-01-0 (1,3-Benzenediol, 5-(1-cyclopentyl-1-methylethyl)- (9CI))
623560-01-0 structure
Product Name:1,3-Benzenediol, 5-(1-cyclopentyl-1-methylethyl)- (9CI)
CAS No:623560-01-0
MF:C14H20O2
MW:220.307404518127
CID:1017002
PubChem ID:45093623
Update Time:2025-04-20
1,3-Benzenediol, 5-(1-cyclopentyl-1-methylethyl)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Benzenediol, 5-(1-cyclopentyl-1-methylethyl)- (9CI)
- DB-278855
- 1,3-Benzenediol, 5-(1-cyclopentyl-1-methylethyl)-
- FIMDONMRFHGDLC-UHFFFAOYSA-N
- 623560-01-0
- 5-(1-Cyclopentyl-1-methyl-ethyl)-benzene-1,3-diol
- SCHEMBL1035840
-
- Inchi： 1S/C14H20O2/c1-14(2,10-5-3-4-6-10)11-7-12(15)9-13(16)8-11/h7-10,15-16H,3-6H2,1-2H3
- InChI Key： FIMDONMRFHGDLC-UHFFFAOYSA-N
- SMILES： OC1C=C(C=C(C=1)C(C)(C)C1CCCC1)O
Computed Properties
- Exact Mass: 220.146
- Monoisotopic Mass: 220.146
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 221
- 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
- Topological Polar Surface Area: 40.5A^2
- XLogP3: 4.5
1,3-Benzenediol, 5-(1-cyclopentyl-1-methylethyl)- (9CI) Related Literature
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Pavel Karásek,Jakub Grym,Michal Roth,Josef Planeta,Franti?ek Foret Lab Chip, 2015,15, 311-318
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Martin R. Ward,Gary W. Copeland,Andrew J. Alexander Chem. Commun., 2010,46, 7634-7636
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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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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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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