Ethyl Cyclobutanecarboxylate

CAT: 0127-OR350159-01Size: 5 gDry Ice: NoHazardous: No

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CAT#:0127-OR350159-01Size:5 g

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CAS Number

14924-53-9

MDL Number

MFCD00001321

Purity

98%

Smiles

CCOC(=O)C1CCC1

Chemical Information

Ethyl cyclobutanecarboxylate

CAS Number	14924-53-9
PubChem CID	84700
IUPAC Name	ethyl cyclobutanecarboxylate
Molecular Formula	C7H12O2
Molecular Weight	128.17
XLogP	1.5
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	9
Formal Charge	0
Complexity	105

SMILES

CCOC(=O)C1CCC1

InChI

InChI=1S/C7H12O2/c1-2-9-7(8)6-4-3-5-6/h6H,2-5H2,1H3

InChIKey

SMVBADCAMQOTOV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 14924-53-9

CID: 84700

Formula: C7H12O2

MW: 128.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	128.17
XLogP3	1.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	128.083729621
Monoisotopic Mass	128.083729621
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	105
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
OR85386-01	Ethyl 3- (hydroxymethyl) cyclobutanecarboxylate
OR82706-01	Ethyl 1- (aminomethyl) cyclobutanecarboxylate
OR305460	Ethyl 1- (4-hydroxybenzyl) cyclobutanecarboxylate
OR949536-01	Methyl cyclobutanecarboxylate
OR1032690-01	Sodium 2- (hydroxymethyl) cyclobutanecarboxylate
OR1062670-01	Tert-Butyl cyclobutanecarboxylate
PC420000-01	Methyl 3,3-difluoro-cyclobutanecarboxylate
OR1046100-01	Cis-Methyl 3- (hydroxymethyl) cyclobutanecarboxylate
PC103237-01	Methyl 1- (4-fluorophenyl) cyclobutanecarboxylate
OR47847	Methyl 1- (4-iodophenyl) cyclobutanecarboxylate

Catalog	Name
449613-01	Ethyl cyclobutanecarboxylate
sc-327019	Ethyl 1- (aminocarbonyl) cyclobutanecarboxylate
CJA60744	Ethyl 1-methyl-3-oxo-cyclobutanecarboxylate
VFA14360	Ethyl 1-amino-1-cyclobutanecarboxylate monohydrochloride
275923-01	Ethyl 1- (tert-butoxycarbonylamino) -3-oxo-cyclobutanecarboxylate
PDA89295-01	Methyl 3- (bromomethyl) cyclobutanecarboxylate
TRC-M297013-10MG	Methyl 3-(bromomethyl)cyclobutanecarboxylate
TRC-P411260-250MG	Propan-2-yl Cyclobutanecarboxylate
455298-01	Methyl 3,3-Difluoro-cyclobutanecarboxylate
ZCA31629-01	Methyl trans-3-Amino-cyclobutanecarboxylate hydrochloride