Cas no 153257-97-7 (Benzene,1,3-difluoro-5-(1-propyn-1-yl)-)
153257-97-7 structure
Product Name:Benzene,1,3-difluoro-5-(1-propyn-1-yl)-
CAS No:153257-97-7
MF:C9H6F2
MW:152.140749454498
CID:98987
PubChem ID:45090546
Update Time:2025-04-18
Benzene,1,3-difluoro-5-(1-propyn-1-yl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzene,1,3-difluoro-5-(1-propyn-1-yl)-
- 1,3-difluoro-5-prop-1-ynylbenzene
- Benzene, 1,3-difluoro-5-(1-propynyl)- (9CI)
- DTXSID60666641
- 153257-97-7
- 1,3-Difluoro-5-(1-Propyn-1-Yl)Benzene
- 1,3-Difluoro-5-(prop-1-yn-1-yl)benzene
- SCHEMBL8005775
-
- Inchi： 1S/C9H6F2/c1-2-3-7-4-8(10)6-9(11)5-7/h4-6H,1H3
- InChI Key： KBILNDPSXJZJHV-UHFFFAOYSA-N
- SMILES： FC1C=C(C=C(C#CC)C=1)F
Computed Properties
- Exact Mass: 152.04378
- Monoisotopic Mass: 152.044
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 176
- 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: 0A^2
- XLogP3: 2.9
Experimental Properties
- PSA: 0
Benzene,1,3-difluoro-5-(1-propyn-1-yl)- Related Literature
-
Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
-
Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
-
Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
-
Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
153257-97-7 (Benzene,1,3-difluoro-5-(1-propyn-1-yl)-) Related Products
- 405-29-8(1-fluoro-4-(2-phenylethynyl)benzene)
- 29778-28-7(1-fluoro-3-(2-phenylethynyl)benzene)
- 151361-87-4(1-Ethynyl-3,5-difluorobenzene)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
Recommended suppliers
Hubei Cuiyuan Biotechnology Co.,Ltd
Gold Member
Audited Supplier
CN Supplier
Reagent
Amadis Chemical Company Limited
Gold Member
Audited Supplier
CN Supplier
Reagent
SHOCHEM(SHANGHAI) CO.,lTD
Gold Member
Audited Supplier
CN Supplier
Bulk
Wuhan Comings Biotechnology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Jinta Yudi Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
