Cyclohexanone oxime

CAT: 0024-sc-353160Size: 100 gDry Ice: NoHazardous: No

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CAT#:0024-sc-353160Size:100 g

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CAS Number

100-64-1

Chemical Information

Cyclohexanone Oxime

Prisms, liquid or light tan crystalline solid. (NTP, 1992)

CAS Number	100-64-1
PubChem CID	7517
IUPAC Name	N-cyclohexylidenehydroxylamine
Molecular Formula	C6H11NO
Molecular Weight	113.16
XLogP	1.2
Topological Polar Surface Area	32.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	8
Formal Charge	0
Complexity	90

SMILES

C1CCC(=NO)CC1

InChI

InChI=1S/C6H11NO/c8-7-6-4-2-1-3-5-6/h8H,1-5H2

InChIKey

VEZUQRBDRNJBJY-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 100-64-1

CID: 7517

Formula: C6H11NO

MW: 113.16

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	113.16
XLogP3	1.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	113.084063974
Monoisotopic Mass	113.084063974
Topological Polar Surface Area	32.6 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	90.7
Isotope Atom Count	0
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-353156	Cycloheptanone oxime
sc-353156A	Cycloheptanone oxime
sc-214786	Cyclohexanone
sc-214786A	Cyclohexanone
sc-257270	Cyclohexanone-d10
sc-234450	Cyclohexanone cyanohydrin
sc-254098	2- (Methylthio) cyclohexanone
sc-276874	4- (Hydroxymethyl) cyclohexanone
sc-277420	4-Hydroxy Cyclohexanone
sc-260609	3- (Trifluoromethyl) cyclohexanone

Catalog	Name
445299-01	Cyclohexanone Oxime
C30570	Cyclohexanone oxime 97%
OR1043562	Cyclohexanone oxime 3-trifluoromethylcarbanilate
OR1012730-01	Cyclohexanone O- ((6- ((((Cyclohexylideneamino) Oxy) Carbonyl) Amino) Hexyl) Carbamoyl) Oxime
10113-75	Cyclohexanone
CS-BX-00305	Cyclohexanone-d10
LC-6995.2	Cyclohexanone pure
3121875	Cyclohexanone A.R.
OR1044253	Cyclohexanone peroxide
500865-01	Cyclohexanone AR