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17471-49-7

17471-49-7 | 2,3-Naphthalenedione, 1,4-dihydro-1,1,4,4-tetramethyl-

CAS No: 17471-49-7 Catalog No: AG001ZW4 MDL No:

Product Description

Catalog Number:
AG001ZW4
Chemical Name:
2,3-Naphthalenedione, 1,4-dihydro-1,1,4,4-tetramethyl-
CAS Number:
17471-49-7
Molecular Formula:
C14H16O2
Molecular Weight:
216.2756
IUPAC Name:
1,1,4,4-tetramethylnaphthalene-2,3-dione
InChI:
InChI=1S/C14H16O2/c1-13(2)9-7-5-6-8-10(9)14(3,4)12(16)11(13)15/h5-8H,1-4H3
InChI Key:
MJHPJDOKQOLLMJ-UHFFFAOYSA-N
SMILES:
O=C1C(=O)C(C)(C)c2c(C1(C)C)cccc2

Properties

Complexity:
305  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.115g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.28g/mol
Monoisotopic Mass:
216.115g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

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