Cas no 156395-08-3 (5-fluoro-1H-Pyrrole-2-carboxaldehyde)
156395-08-3 structure
Product Name:5-fluoro-1H-Pyrrole-2-carboxaldehyde
CAS No:156395-08-3
MF:C5H4FNO
MW:113.089764595032
CID:1106869
PubChem ID:77231574
Update Time:2025-04-20
5-fluoro-1H-Pyrrole-2-carboxaldehyde Chemical and Physical Properties
Names and Identifiers
-
- 5-fluoro-1H-Pyrrole-2-carboxaldehyde
- 5-fluoro-1H-pyrrole-2-carbaldehyde
- 156395-08-3
- DA-16954
-
- Inchi: 1S/C5H4FNO/c6-5-2-1-4(3-8)7-5/h1-3,7H
- InChI Key: XLVPYILAGRFONZ-UHFFFAOYSA-N
- SMILES: FC1=CC=C(C=O)N1
Computed Properties
- Exact Mass: 113.02772
- Monoisotopic Mass: 113.027691913g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 1
- Complexity: 96.4
- 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: 0.9
- Topological Polar Surface Area: 32.9?2
Experimental Properties
- PSA: 32.86
5-fluoro-1H-Pyrrole-2-carboxaldehyde Related Literature
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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