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101743-46-8

101743-46-8 | 1-Naphthaleneoctanoic acid, η-oxo-

CAS No: 101743-46-8 Catalog No: AG0005E1 MDL No:

Product Description

Catalog Number:
AG0005E1
Chemical Name:
1-Naphthaleneoctanoic acid, η-oxo-
CAS Number:
101743-46-8
Molecular Formula:
C18H20O3
Molecular Weight:
284.3496
IUPAC Name:
8-naphthalen-1-yl-8-oxooctanoic acid
InChI:
InChI=1S/C18H20O3/c19-17(12-3-1-2-4-13-18(20)21)16-11-7-9-14-8-5-6-10-15(14)16/h5-11H,1-4,12-13H2,(H,20,21)
InChI Key:
DBOKWZXDDSWWIT-UHFFFAOYSA-N
SMILES:
OC(=O)CCCCCCC(=O)c1cccc2c1cccc2

Properties

Complexity:
350  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.141g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
284.355g/mol
Monoisotopic Mass:
284.141g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  

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