Cas no 221013-25-8 (Benzaldehyde,2-(fluoromethoxy)-)
221013-25-8 structure
Product Name:Benzaldehyde,2-(fluoromethoxy)-
CAS No:221013-25-8
MF:C8H7FO2
MW:154.138386011124
CID:244110
PubChem ID:20061507
Update Time:2025-04-19
Benzaldehyde,2-(fluoromethoxy)- Chemical and Physical Properties
Names and Identifiers
-
- Benzaldehyde,2-(fluoromethoxy)-
- 2-(Fluoromethoxy)benzaldehyde
- SCHEMBL834422
- DTXSID50602013
- 221013-25-8
- 2-fluoromethoxybenzaldehyde
- Fluormethoxybenzaldehyd
- Benzaldehyde, 2-(fluoromethoxy)- (9CI)
- NVSAAKRWQJRUKN-UHFFFAOYSA-N
-
- Inchi： 1S/C8H7FO2/c9-6-11-8-4-2-1-3-7(8)5-10/h1-5H,6H2
- InChI Key： NVSAAKRWQJRUKN-UHFFFAOYSA-N
- SMILES： FCOC1C=CC=CC=1C=O
Computed Properties
- Exact Mass: 154.04301
- Monoisotopic Mass: 154.04300762g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 3
- Complexity: 127
- 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: 26.3?2
Experimental Properties
- PSA: 26.3
Benzaldehyde,2-(fluoromethoxy)- Related Literature
-
J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
-
Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
-
Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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