1-Prop-2-ynylcyclohexane

CAT: 0127-OR25672-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-OR25672-01Size:1 g

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CAS Number

17715-00-3

Synonyms

3-Cyclohexyl-1-propyne

MDL Number

MFCD00041562

Purity

=95%

Smiles

C#CCC1CCCCC1

Chemical Information

(Prop-2-yn-1-yl)cyclohexane

CAS Number	17715-00-3
PubChem CID	87265
IUPAC Name	prop-2-ynylcyclohexane
Molecular Formula	C9H14
Molecular Weight	122.21
XLogP	3.5
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Heavy Atom Count	9
Formal Charge	0
Complexity	109

SMILES

C#CCC1CCCCC1

InChI

InChI=1S/C9H14/c1-2-6-9-7-4-3-5-8-9/h1,9H,3-8H2

InChIKey

UARFKZSJGDQRLF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 17715-00-3

CID: 87265

Formula: C9H14

MW: 122.21

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	122.21
XLogP3	3.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Exact Mass	122.109550447
Monoisotopic Mass	122.109550447
Topological Polar Surface Area	0 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	109
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
OR1031264-01	3- (3- (Prop-2-yn-1-yloxy) -2,2-bis ((prop-2-yn-1-yloxy) methyl) propoxy) prop-1-yne
OR961761-01	1-Methyl-prop-2-ynylamine
OR74519	Prop-2-yn-1-ylbenzene
PC7760	2- (Trifluoromethyl) prop-1-ene
OR1059267-01	1- (2-Chlorophenyl) prop-2-yn-1-one
PC107101	3- (1,1,2,2,2-Pentafluoroethoxy) prop-1-ene
OR1044911-01	Prop-2-yn-1-yl 2-oxopropanoate
OR1040199-01	2- (Prop-2-yn-1-yloxy) aniline
OR97176	2- (Methoxymethyl) prop-2-en-1-ol
OR1039505-01	2- (Prop-2-en-1-yl) benzaldehyde

Catalog	Name
JH666021	Prop-2-enyl prop-2-ene-1-sulfonate
AAA59288	3- (Prop-2-en-1-ylsulfanyl) prop-1-ene
EAA67274-01	Prop-2-ynoyl prop-2-ynoate
abx187840-01	3-(2-[2-(Prop-2-yn-1-yloxy)ethoxy]ethoxy)prop-1-yne
FH LZ 0013-01	1- (10-prop-2-enoylanthracen-9-yl) prop-2-en-1-one
LDA19928-01	Bis (prop-2-en-1-yl) (prop-2-yn-1-yl) amine
sc-339122	1-prop-2-ynylpiperazine dihydrochloride
AR-B06463-01	Prop-1-en-2-ylbenzene
JH600352	1- (prop-2-enyldisulfanyl) propane
sc-345508	2-[prop-1-enyl]phenol