Cyclohexanone-d10

CAT: 0024-sc-257270Size: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-257270Size:1 g

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CAS Number

51209-49-5

Chemical Information

(2H10)Cyclohexanone

CAS Number	51209-49-5
PubChem CID	12998629
IUPAC Name	2,2,3,3,4,4,5,5,6,6-decadeuteriocyclohexan-1-one
Molecular Formula	C6H10O
Molecular Weight	108.20
XLogP	0.8
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Heavy Atom Count	7
Formal Charge	0
Complexity	68

SMILES

[2H]C1(C(=O)C(C(C(C1([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])[2H]

InChI

InChI=1S/C6H10O/c7-6-4-2-1-3-5-6/h1-5H2/i1D2,2D2,3D2,4D2,5D2

InChIKey

JHIVVAPYMSGYDF-YXALHFAPSA-N

Chemical Structure

2D Structure

CAS: 51209-49-5

CID: 12998629

Formula: C6H10O

MW: 108.20

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	108.20
XLogP3	0.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	108.135932398
Monoisotopic Mass	108.135932398
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	68.2
Isotope Atom Count	10
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-214786	Cyclohexanone
sc-214786A	Cyclohexanone
sc-353160	Cyclohexanone oxime
sc-353160A	Cyclohexanone oxime
sc-234450	Cyclohexanone cyanohydrin
sc-254098	2- (Methylthio) cyclohexanone
sc-276874	4- (Hydroxymethyl) cyclohexanone
sc-277420	4-Hydroxy Cyclohexanone
sc-260609	3- (Trifluoromethyl) cyclohexanone
sc-487000	Cyclohexanone p-Toluenesulfonylhydrazone

Catalog	Name
CS-BX-00305	Cyclohexanone-d10
10113-75	Cyclohexanone
LC-6995.2	Cyclohexanone pure
3121875	Cyclohexanone A.R.
TRC-C987982-1G	Cyclohexanone-d6
500865-01	Cyclohexanone AR
OR1044253	Cyclohexanone peroxide
GTR19251193-01	Cyclohexanone oxime
163237	Cyclohexanone-13C6
027871-01	Cyclohexanone for Synthesis