Text Search
Structure Search

adamantane-2,6-dione

adamantane-2,6-dione

CAS: 39751-07-0

Formula: C10H12O2

SMILES: O=C1C2CC3CC1CC(C2)C3=O

IUPAC: adamantane-2,6-dione

InChI: InChI=1S/C10H12O2/c11-9-5-1-6-3-8(9)4-7(2-5)10(6)12/h5-8H,1-4H2

Composition: C (73.15%), H (7.37%), O (19.49%)

Molar Mass: 164.204

Atom Count: 24

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 164.083729626
Formal Charge 0
FSP3 0.8
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey UBIAKEDDKXHXTB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 43.58
Topological Polar Surface Area 34.14
Polarizability 17.12
Ring Count 3
Rotatable Bond Count 0

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 39751-07-0 $16.39-$709.94$16.39$22.70$54.22$187.89$709.94
Request Quote