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1871142-48-1 | 3-fluoro-5-(3-methoxyazetidin-1-yl)benzaldehyde
CAS No: 1871142-48-1 Catalog No: AG01C8S3 MDL No:MFCD31443227
Product Description
Catalog Number:
AG01C8S3
Chemical Name:
3-fluoro-5-(3-methoxyazetidin-1-yl)benzaldehyde
CAS Number:
1871142-48-1
Molecular Formula:
C11H12FNO2
Molecular Weight:
209.2169
MDL Number:
MFCD31443227
IUPAC Name:
3-fluoro-5-(3-methoxyazetidin-1-yl)benzaldehyde
InChI:
InChI=1S/C11H12FNO2/c1-15-11-5-13(6-11)10-3-8(7-14)2-9(12)4-10/h2-4,7,11H,5-6H2,1H3
InChI Key:
WXGNKSAXNNGSII-UHFFFAOYSA-N
SMILES:
COC1CN(C1)c1cc(F)cc(c1)C=O
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.085g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.22g/mol
Monoisotopic Mass:
209.085g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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