Cas no 67640-29-3 (Benzenemethanol,3-chloro-2,4,5,6-tetrafluoro-)
67640-29-3 structure
Product Name:Benzenemethanol,3-chloro-2,4,5,6-tetrafluoro-
CAS No:67640-29-3
MF:C7H3ClF4O
MW:214.544735193253
CID:502318
PubChem ID:17750854
Update Time:2025-04-19
Benzenemethanol,3-chloro-2,4,5,6-tetrafluoro- Chemical and Physical Properties
Names and Identifiers
-
- Benzenemethanol,3-chloro-2,4,5,6-tetrafluoro-
- (3-Chloro-2,4,5,6-tetrafluorophenyl)methanol
- 3-CHLORO-2,4,5,6-TETRAFLUOROBENZYLALCOHOL
- 2,4,5,6-Tetrafluor-3-chlor-benzylalkohol
- AG-G-56032
- AGN-PC-01LRI0
- C141
- CTK5C6468
- FT-0615302
- KB-30806
- 67640-29-3
- DTXSID90590723
-
- Inchi： 1S/C7H3ClF4O/c8-3-4(9)2(1-13)5(10)7(12)6(3)11/h13H,1H2
- InChI Key： NVCPZBVRLBQWDL-UHFFFAOYSA-N
- SMILES： ClC1=C(C(=C(C(CO)=C1F)F)F)F
Computed Properties
- Exact Mass: 213.98089
- Monoisotopic Mass: 213.9808551g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 182
- 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: 2.1
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- PSA: 20.23
Benzenemethanol,3-chloro-2,4,5,6-tetrafluoro- Related Literature
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
-
Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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