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23328-38-3 | 2,5-Hexanedione, 3,3,4,4-tetramethyl-
CAS No: 23328-38-3 Catalog No: AG002MVY MDL No:
Product Description
Catalog Number:
AG002MVY
Chemical Name:
2,5-Hexanedione, 3,3,4,4-tetramethyl-
CAS Number:
23328-38-3
Molecular Formula:
C10H18O2
Molecular Weight:
170.2487
IUPAC Name:
3,3,4,4-tetramethylhexane-2,5-dione
InChI:
InChI=1S/C10H18O2/c1-7(11)9(3,4)10(5,6)8(2)12/h1-6H3
InChI Key:
UMSOYACOXSGLNT-UHFFFAOYSA-N
SMILES:
CC(=O)C(C(C(=O)C)(C)C)(C)C
NSC Number:
33712
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.131g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.252g/mol
Monoisotopic Mass:
170.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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