Methyl 9-octadecynoate

CAT: 0024-sc-269560Size: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-269560Size:1 g

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CAS Number

1120-32-7

Chemical Information

Methyl octadec-9-ynoate

CAS Number	1120-32-7
PubChem CID	534587
IUPAC Name	methyl octadec-9-ynoate
Molecular Formula	C19H34O2
Molecular Weight	294.5
XLogP	7.3
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	14
Heavy Atom Count	21
Formal Charge	0
Complexity	295

SMILES

CCCCCCCCC#CCCCCCCCC(=O)OC

InChI

InChI=1S/C19H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h3-9,12-18H2,1-2H3

InChIKey

VGXHOYHYUMFLPG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1120-32-7

CID: 534587

Formula: C19H34O2

MW: 294.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	294.5
XLogP3	7.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	14
Exact Mass	294.255880323
Monoisotopic Mass	294.255880323
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	295
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-211874	Methyl 9-Acridinecarboxylate
sc-484224	Methyl 9-Oxononanoate
sc-233779	α-Methyl-9-anthracenemethanol
sc-485803	Methyl 9-Formylnonanoate
sc-228564	Methyl 9-fluorenylideneacetate
sc-484224C	Methyl 9-Oxononanoate
sc-484224A	Methyl 9-Oxononanoate
sc-484224B	Methyl 9-Oxononanoate
sc-210713	(9-Phenanthryl) methyl Methacrylate
sc-207223	9-Methyl-d3 Adenine

Catalog	Name
GTR19277598-01	Methyl 9-octadecynoate
OR28883	Methyl 9-chloro-9-oxononanoate
PC32502	Methyl 9-[methyl-4- (trifluoromethoxy) anilino]-9-oxononanoate
NFA27101-01	9-Methyl risperidone
CS-O-07532	9-Methyl Acridine
455849-01	Methyl 9-Octadecenoate
MBS392512-01	Methyl 9-Decenoate
abx180814-01	Methyl 9-hydroxynonanoate
HY-W337894-01	Methyl 9-oxooctadecanoate
HY-W088462	Methyl 9-bromononanoate