1,1-Diacetylcyclopropane

CAT: 0024-sc-499840Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-499840Size:100 mg

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CAS Number

695-70-5

Chemical Information

1,1-Diacetylcyclopropane

CAS Number	695-70-5
PubChem CID	272129
IUPAC Name	1-(1-acetylcyclopropyl)ethanone
Molecular Formula	C7H10O2
Molecular Weight	126.15
XLogP	0.1
Topological Polar Surface Area	34.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	9
Formal Charge	0
Complexity	150

SMILES

CC(=O)C1(CC1)C(=O)C

InChI

InChI=1S/C7H10O2/c1-5(8)7(3-4-7)6(2)9/h3-4H2,1-2H3

InChIKey

KLELEQGKTUGEPV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 695-70-5

CID: 272129

Formula: C7H10O2

MW: 126.15

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	126.15
XLogP3	0.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	126.068079557
Monoisotopic Mass	126.068079557
Topological Polar Surface Area	34.1 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	150
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-472973	1,1,1-Trichlorotrifluoroethane
sc-475337	1,1,1-Trimethoxyoctane
sc-258860A	1,1,1-Trichlorotrifluoroacetone
sc-476086	1,1,1-Trichloroacetone
sc-258860	1,1,1-Trichlorotrifluoroacetone
sc-482760	1,1'-Bicyclo[1,1,1]pentane-1,3-dimethyl alcohol
sc-484400	1,1'-Bicyclo[1,1,1]pentane-1,3-dicarboxylic acid
sc-477150	1,1':2',1'':2'',1'''-Quaterphenyl
sc-297886	1,1,1-Trifluoroacetone oxime
sc-475019	1,1,1-13C-Tripalmitin

Catalog	Name
MBS6119843-01	1,1-Diacetylcyclopropane
OF59775-01	1,1,1,1,1-Kestoheptaose
OK59466-01	1,1,1,1-Kestohexose
GTR19169514-01	1,1,1,1-Kestohexaose
TRC-T773995-100MG	1,1,1-Trichloromethanesulfonic Acid 1,1'-Anhydride
HY-157129	AMPK-α1β1γ1 activator 1
OR300179	1-Isothiocyanatobicyclo[1.1.1]pentane
OR300174	1-Isocyanatobicyclo[1.1.1]pentane
DFA88480-01	1-Bromobicyclo[1.1.1]pentane