[ (1,1-Dimethylethoxy) methyl]-cyclopropane

CAT: 0024-sc-498484Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-498484Size:100 mg

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CAS Number

1235439-88-9

Chemical Information

[(Tert-butoxy)methyl]cyclopropane

CAS Number	1235439-88-9
PubChem CID	21061573
IUPAC Name	(2-methylpropan-2-yl)oxymethylcyclopropane
Molecular Formula	C8H16O
Molecular Weight	128.21
XLogP	1.8
Topological Polar Surface Area	9.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Heavy Atom Count	9
Formal Charge	0
Complexity	87

SMILES

CC(C)(C)OCC1CC1

InChI

InChI=1S/C8H16O/c1-8(2,3)9-6-7-4-5-7/h7H,4-6H2,1-3H3

InChIKey

PGTIPHYWXVHGFM-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1235439-88-9

CID: 21061573

Formula: C8H16O

MW: 128.21

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	128.21
XLogP3	1.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Exact Mass	128.120115130
Monoisotopic Mass	128.120115130
Topological Polar Surface Area	9.2 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	87.2
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-228483	Methyl 1- (trifluoromethyl) cyclopropane-1-carboxylate
sc-498001	N-[ (1,1-Dimethylethoxy) carbonyl]serine Methyl Ester
sc-498990	N- (1,1-Dimethylethoxy) carbonyl N- (4-Hydroxymethylcyclohexyl) methyl-tranexamic Acid Methyl Ester
sc-239626	Cyclopropane-1,1-dicarboxylic acid
sc-497180	1-Ethynyl-1- (triisopropylsilyloxy) cyclopropane
sc-224830	1,1-Bis (hydroxymethyl) cyclopropane
sc-252710	Diethyl cyclopropane-1,1-dicarboxylate
sc-252710A	Diethyl cyclopropane-1,1-dicarboxylate
sc-397079	1-Formyl-1- (triisopropylsilyloxy) cyclopropane
sc-496612	4-[2-[[ (1,1-Dimethylethoxy) carbonyl]methylamino]ethoxy]benzenepropanoic acid methyl ester

Catalog	Name
158575	[ (1,1-Dimethylethoxy) methyl]-cyclopropane
OR1100747-01	Methyl 2-[ (1,1-dimethylethoxy) methyl]benzoate
OR28707	Methyl cyclopropane-1-carboxylate
OR1101141-01	2-[ (1,1-Dimethylethoxy) methyl]benzaldehyde
AR-H01075-01	3-[ (1,1-Dimethylethoxy) methyl]heptane
AFC47385-01	1- (Isocyanatomethyl) -1-[ (methylsulfanyl) methyl]cyclopropane
UEA11166-01	Methyl 1- (methylamino) cyclopropane-1-carboxylate
OR1037337-01	Methyl 1- (bromomethyl) cyclopropane-1-carboxylate
PC1058-01	Methyl 1- (trifluoromethyl) cyclopropane-1-carboxylate
OR1002852-01	Methyl 4-[ (1,1-Dimethylethoxy) carbonyl]benzeneundecynoate