Cas no 575488-42-5 (Benzenemethanol, 3,5-difluoro-alpha-methyl-, (-)- (9CI))
575488-42-5 structure
Product Name:Benzenemethanol, 3,5-difluoro-alpha-methyl-, (-)- (9CI)
CAS No:575488-42-5
MF:C8H8F2O
MW:158.145329475403
CID:947207
Update Time:2024-06-13
Benzenemethanol, 3,5-difluoro-alpha-methyl-, (-)- (9CI) Chemical and Physical Properties
Names and Identifiers
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- Benzenemethanol, 3,5-difluoro-alpha-methyl-, (-)- (9CI)
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- Inchi： 1S/C8H8F2O/c1-5(11)6-2-7(9)4-8(10)3-6/h2-5,11H,1H3
- InChI Key： UEGDJZYKJPZJAA-UHFFFAOYSA-N
- SMILES： C1(C(C)O)=CC(F)=CC(F)=C1
Computed Properties
- Exact Mass: 158.054
- Monoisotopic Mass: 158.054
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 119
- 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
Experimental Properties
- PSA: 20.23000
- LogP: 2.01810
Benzenemethanol, 3,5-difluoro-alpha-methyl-, (-)- (9CI) Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
575488-42-5 (Benzenemethanol, 3,5-difluoro-alpha-methyl-, (-)- (9CI)) Related Products
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- 321318-21-2(1-(3,4-Difluorophenyl)ethanol)
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- 126534-32-5((S)-1-(3-Fluorophenyl)ethanol)
- 467223-90-1(3,5-Difluorophenethyl alcohol)
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