Cas no 186308-52-1 (Benzaldehyde,5-fluoro-2,3-dihydroxy-)
186308-52-1 structure
Product Name:Benzaldehyde,5-fluoro-2,3-dihydroxy-
CAS No:186308-52-1
MF:C7H5FO3
MW:156.111205816269
CID:114790
PubChem ID:45083896
Update Time:2025-04-18
Benzaldehyde,5-fluoro-2,3-dihydroxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzaldehyde,5-fluoro-2,3-dihydroxy-
- 5-fluoro-2,3-dihydroxybenzaldehyde
- Benzaldehyde, 5-fluoro-2,3-dihydroxy- (9CI)
- SCHEMBL12697428
- 186308-52-1
- DTXSID40665511
-
- Inchi： 1S/C7H5FO3/c8-5-1-4(3-9)7(11)6(10)2-5/h1-3,10-11H
- InChI Key： DPGQRVPEZSTHQH-UHFFFAOYSA-N
- SMILES： FC1C=C(C(=C(C=O)C=1)O)O
Computed Properties
- Exact Mass: 156.02225
- Monoisotopic Mass: 156.022
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 151
- 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: 57.5A^2
- XLogP3: 1.3
Experimental Properties
- PSA: 57.53
Benzaldehyde,5-fluoro-2,3-dihydroxy- Related Literature
-
M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
-
Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Piotr Szcze?niak,Sebastian Stecko RSC Adv., 2015,5, 30882-30888
-
Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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