Products for Research Use Only

Spiro[3.6]decan-2-one

CAT: 0926-PXB57301-01Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0926-PXB57301-01Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1189573-01-0
MDL Number
MFCD23884028
Smiles
C1CCCC2 (CC1) CC (=O) C2
Molecular Formula
C10H16O
Molecular Weight
152.2 g/mol
Controlled
No

Chemical Information

Spiro[3.6]decan-2-one
CAS Number1189573-01-0
PubChem CID80361566
IUPAC Namespiro[3.6]decan-2-one
Molecular FormulaC10H16O
Molecular Weight152.23
XLogP2.8
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity154
SMILES
C1CCCC2(CC1)CC(=O)C2
InChI
InChI=1S/C10H16O/c11-9-7-10(8-9)5-3-1-2-4-6-10/h1-8H2
InChIKey
DVQMAZDBXPLLIY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Spiro[3.6]decan-2-one
CAS: 1189573-01-0
CID: 80361566
Formula: C10H16O
MW: 152.23
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight152.23
XLogP32.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass152.120115130
Monoisotopic Mass152.120115130
Topological Polar Surface Area17.1 Ų
Heavy Atom Count11
Formal Charge0
Complexity154
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes