1-Ethynylnaphthalene

CAT: 0024-sc-224674Size: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-224674Size:5 g

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CAS Number

15727-65-8

Chemical Information

1-Ethynylnaphthalene

CAS Number	15727-65-8
PubChem CID	123357
IUPAC Name	1-ethynylnaphthalene
Molecular Formula	C12H8
Molecular Weight	152.19
XLogP	3.8
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Heavy Atom Count	12
Formal Charge	0
Complexity	195

SMILES

C#CC1=CC=CC2=CC=CC=C21

InChI

InChI=1S/C12H8/c1-2-10-7-5-8-11-6-3-4-9-12(10)11/h1,3-9H

InChIKey

MCZUXEWWARACSP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 15727-65-8

CID: 123357

Formula: C12H8

MW: 152.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	152.19
XLogP3	3.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Exact Mass	152.062600255
Monoisotopic Mass	152.062600255
Topological Polar Surface Area	0 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	195
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-485192	2-Ethynylnaphthalene
sc-230291	2-Ethylnaphthalene
sc-476086	1,1,1-Trichloroacetone
sc-258860	1,1,1-Trichlorotrifluoroacetone
sc-472973	1,1,1-Trichlorotrifluoroethane
sc-475337	1,1,1-Trimethoxyoctane
sc-258860A	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

Catalog	Name
MBS3844419-01	1-Ethynylnaphthalene
A19967-1000	1-Ethynylnaphthalene 1g
A19967-500	1-Ethynylnaphthalene 500mg
A19967-100	1-Ethynylnaphthalene 100mg
OR40103-01	2-Ethynylnaphthalene
A19967-10mM-D	1-Ethynylnaphthalene 10mM * 1mL in DMSO
OF59775-01	1,1,1,1,1-Kestoheptaose
N2864-5.1	1,1,1,1-Kestohexaose
112040	1,1,1,1-Kestohexose