Cas no 65565-62-0 (Phenol, 2-chloro-6-(1-methylbutyl)-)
65565-62-0 structure
Product Name:Phenol, 2-chloro-6-(1-methylbutyl)-
CAS No:65565-62-0
MF:C11H15ClO
MW:198.689202547073
CID:398310
PubChem ID:15584176
Update Time:2025-04-19
Phenol, 2-chloro-6-(1-methylbutyl)- Chemical and Physical Properties
Names and Identifiers
-
- Phenol, 2-chloro-6-(1-methylbutyl)-
- 2-chloro-6-pentan-2-ylphenol
- DTXSID50574928
- 65565-62-0
- 2-Chloro-6-(pentan-2-yl)phenol
- SCHEMBL19780142
-
- Inchi： 1S/C11H15ClO/c1-3-5-8(2)9-6-4-7-10(12)11(9)13/h4,6-8,13H,3,5H2,1-2H3
- InChI Key： NUOZIQVIWOZYMF-UHFFFAOYSA-N
- SMILES： ClC1=CC=CC(=C1O)C(C)CCC
Computed Properties
- Exact Mass: 198.08125
- Monoisotopic Mass: 198.0811428g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 149
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.4
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- PSA: 20.23
Phenol, 2-chloro-6-(1-methylbutyl)- Related Literature
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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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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
65565-62-0 (Phenol, 2-chloro-6-(1-methylbutyl)-) Related Products
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