Ethynylcyclopropane

CAT: 1299-RG-A260127-04Size: 100 mgDry Ice: NoHazardous: No

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CAT#:1299-RG-A260127-04Size:100 mg

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CAS Number

6746-94-7

Synonyms

Ethynylcyclopropane

Molecular Formula

C5H6

Molecular Weight

66.1

Product Name Synonym

Ethynylcyclopropane

Chemical Information

Cyclopropylacetylene

CAS Number	6746-94-7
PubChem CID	138823
IUPAC Name	ethynylcyclopropane
Molecular Formula	C5H6
Molecular Weight	66.10
XLogP	1.5
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Heavy Atom Count	5
Formal Charge	0
Complexity	69

SMILES

C#CC1CC1

InChI

InChI=1S/C5H6/c1-2-5-3-4-5/h1,5H,3-4H2

InChIKey

NPTDXPDGUHAFKC-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 6746-94-7

CID: 138823

Formula: C5H6

MW: 66.10

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	66.10
XLogP3	1.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Exact Mass	66.0469501914
Monoisotopic Mass	66.0469501914
Topological Polar Surface Area	0 Å²
Heavy Atom Count	5
Formal Charge	0
Complexity	69.3
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
OR11148-01	Ethynylcyclopropane
PC250027	1- (difluoromethyl) -1-ethynylcyclopropane
IUB65843-01	1-Ethynylcyclopropane-1-sulfonamide
OR1049345-01	Methyl 1-ethynylcyclopropane-1-carboxylate
MKD82337-01	1-Ethynylcyclopropane-1-sulfonyl fluoride
sc-391390	1- (tert-Butyldimethylsilyloxy) -1- (2′-trimethylsilyl) ethynylcyclopropane
OR1032659-01	Cis-Methyl (1R,2S) -2-ethynylcyclopropane-1-carboxylate