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Home > Fluorides > 1439899-37-2
1439899-37-2 | 6'-Fluoro-2',4'-dihydro-1'H-spiro[oxane-4,3'-quinoline]
CAS No: 1439899-37-2 Catalog No: AG01F7RC MDL No:
Product Description
Catalog Number:
AG01F7RC
Chemical Name:
6'-Fluoro-2',4'-dihydro-1'H-spiro[oxane-4,3'-quinoline]
CAS Number:
1439899-37-2
Molecular Formula:
C13H16FNO
Molecular Weight:
221.2706
IUPAC Name:
6-fluorospiro[2,4-dihydro-1H-quinoline-3,4'-oxane]
InChI:
InChI=1S/C13H16FNO/c14-11-1-2-12-10(7-11)8-13(9-15-12)3-5-16-6-4-13/h1-2,7,15H,3-6,8-9H2
InChI Key:
IBTUGWLNMISBLR-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)CC1(CN2)CCOCC1
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.122g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
221.275g/mol
Monoisotopic Mass:
221.122g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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