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306934-88-3 | 4H-1,3-Benzodioxin-8-methanamine, 6-fluoro-
CAS No: 306934-88-3 Catalog No: AG0030UB MDL No:MFCD02677704
Product Description
Catalog Number:
AG0030UB
Chemical Name:
4H-1,3-Benzodioxin-8-methanamine, 6-fluoro-
CAS Number:
306934-88-3
Molecular Formula:
C9H10FNO2
Molecular Weight:
183.1796
MDL Number:
MFCD02677704
IUPAC Name:
(6-fluoro-4H-1,3-benzodioxin-8-yl)methanamine
InChI:
InChI=1S/C9H10FNO2/c10-8-1-6(3-11)9-7(2-8)4-12-5-13-9/h1-2H,3-5,11H2
InChI Key:
JNFVSJNYOFOUDD-UHFFFAOYSA-N
SMILES:
NCc1cc(F)cc2c1OCOC2
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.07g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
183.182g/mol
Monoisotopic Mass:
183.07g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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