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Home Other Building Blocks (S)-6-Fluoro-1-isopropyl-3,4-dihydronaphthalen-2(1H)-one

(S)-6-Fluoro-1-isopropyl-3,4-dihydronaphthalen-2(1H)-one

CAS No.:
104205-01-8
Catalog Number:
AG007YEB
Molecular Formula:
C13H15FO
Molecular Weight:
206.2560
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Product Description
Catalog Number:
AG007YEB
Chemical Name:
(S)-6-Fluoro-1-isopropyl-3,4-dihydronaphthalen-2(1H)-one
CAS Number:
104205-01-8
Molecular Formula:
C13H15FO
Molecular Weight:
206.2560
MDL Number:
MFCD20257803
IUPAC Name:
(1S)-6-fluoro-1-propan-2-yl-3,4-dihydro-1H-naphthalen-2-one
InChI:
InChI=1S/C13H15FO/c1-8(2)13-11-5-4-10(14)7-9(11)3-6-12(13)15/h4-5,7-8,13H,3,6H2,1-2H3/t13-/m0/s1
InChI Key:
DEGWMPOIXJTKLT-ZDUSSCGKSA-N
SMILES:
CC([C@@H]1C(=O)CCc2c1ccc(c2)F)C
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
206.111g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.26g/mol
Monoisotopic Mass:
206.111g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties