Methyl 2-cyclopropyl-2-methoxyacetate

CAT: 0926-JJC68643-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-JJC68643-01Size:50 mg

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CAS Number

1484686-43-2

MDL Number

MFCD21287139

Smiles

COC (C1CC1) C (=O) OC

Molecular Formula

C7H12O3

Molecular Weight

144.17 g/mol

Controlled

Chemical Information

Methyl 2-cyclopropyl-2-methoxyacetate

CAS Number	1484686-43-2
PubChem CID	65682190
IUPAC Name	methyl 2-cyclopropyl-2-methoxyacetate
Molecular Formula	C7H12O3
Molecular Weight	144.17
XLogP	0.8
Topological Polar Surface Area	35.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Heavy Atom Count	10
Formal Charge	0
Complexity	129

SMILES

COC(C1CC1)C(=O)OC

InChI

InChI=1S/C7H12O3/c1-9-6(5-3-4-5)7(8)10-2/h5-6H,3-4H2,1-2H3

InChIKey

XHLNRJUTEWGDMR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1484686-43-2

CID: 65682190

Formula: C7H12O3

MW: 144.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	144.17
XLogP3	0.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	144.078644241
Monoisotopic Mass	144.078644241
Topological Polar Surface Area	35.5 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	129
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
FDD54859-01	Methyl 2-cyclopentyl-2-methoxyacetate
EEA03661-01	Methyl 2-cyclohexyl-2-methoxyacetate
NCA69751-01	Methyl 2- (2-hydroxyphenyl) -2-methoxyacetate
SAA64022-01	Butyl 2-methoxyacetate
AVD27024-01	Methyl 2- (azetidin-3-yl) -2-methoxyacetate hydrochloride
YDA73093-01	Methyl 2-cyclopropyl-2-hydroxyacetate
SIC49788-01	Methyl 2-cyclopropyl-2-sulfanylacetate
YID06343-01	Methyl 3-cyclopropyl-2,2-dimethylpropanoate
AFC47296-01	Methyl 2-{1-[ (fluorosulfonyl) methyl]cyclopropyl}acetate
DFA23072-01	(2,2-Difluoro-1-methyl-cyclopropyl) methanol

Catalog	Name
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