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Home > Aldehydes > 1781868-42-5
1781868-42-5 | 6-fluoro-2,3-dihydro-1,4-benzodioxine-5-carbaldehyde
CAS No: 1781868-42-5 Catalog No: AG01C9PR MDL No:MFCD28647477
Product Description
Catalog Number:
AG01C9PR
Chemical Name:
6-fluoro-2,3-dihydro-1,4-benzodioxine-5-carbaldehyde
CAS Number:
1781868-42-5
Molecular Formula:
C9H7FO3
Molecular Weight:
182.1485
MDL Number:
MFCD28647477
IUPAC Name:
6-fluoro-2,3-dihydro-1,4-benzodioxine-5-carbaldehyde
InChI:
InChI=1S/C9H7FO3/c10-7-1-2-8-9(6(7)5-11)13-4-3-12-8/h1-2,5H,3-4H2
InChI Key:
BXTXPWFYOAKYBX-UHFFFAOYSA-N
SMILES:
O=Cc1c(F)ccc2c1OCCO2
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.038g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.15g/mol
Monoisotopic Mass:
182.038g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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