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6886-64-2

6886-64-2 | 3-FLUORANTHENEBUTANOIC ACID

CAS No: 6886-64-2 Catalog No: AG006GHA MDL No:

Product Description

Catalog Number:
AG006GHA
Chemical Name:
3-FLUORANTHENEBUTANOIC ACID
CAS Number:
6886-64-2
Molecular Formula:
C20H16O2
Molecular Weight:
288.3398
IUPAC Name:
4-fluoranthen-3-ylbutanoic acid
InChI:
InChI=1S/C20H16O2/c21-19(22)10-3-5-13-11-12-18-16-7-2-1-6-15(16)17-9-4-8-14(13)20(17)18/h1-2,4,6-9,11-12H,3,5,10H2,(H,21,22)
InChI Key:
VUUCGMUWSNNVEC-UHFFFAOYSA-N
SMILES:
OC(=O)CCCc1ccc2c3c1cccc3c1c2cccc1

Properties

Complexity:
418  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.115g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
288.346g/mol
Monoisotopic Mass:
288.115g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  

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