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1019379-49-7

1019379-49-7 | 1-Naphthalenebutanoic acid, α,γ-dioxo-, ethyl ester

CAS No: 1019379-49-7 Catalog No: AG000607 MDL No:MFCD00420372

Product Description

Catalog Number:
AG000607
Chemical Name:
1-Naphthalenebutanoic acid, α,γ-dioxo-, ethyl ester
CAS Number:
1019379-49-7
Molecular Formula:
C16H14O4
Molecular Weight:
270.2800
MDL Number:
MFCD00420372
IUPAC Name:
ethyl 4-naphthalen-1-yl-2,4-dioxobutanoate
InChI:
InChI=1S/C16H14O4/c1-2-20-16(19)15(18)10-14(17)13-9-5-7-11-6-3-4-8-12(11)13/h3-9H,2,10H2,1H3
InChI Key:
ZZXPDQIRXRJXEI-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=O)CC(=O)c1cccc2c1cccc2

Properties

Complexity:
388  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.089g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.284g/mol
Monoisotopic Mass:
270.089g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
60.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

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