2-Hexylidenecyclopentanone

CAT: 0024-sc-490682CSize: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-490682CSize:1 g

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CAS Number

17373-89-6

Chemical Information

2-Hexylidenecyclopentanone

2-Hexylidenecyclopentanone is a cyclic ketone.

CAS Number	17373-89-6
PubChem CID	6385721
IUPAC Name	(2E)-2-hexylidenecyclopentan-1-one
Molecular Formula	C11H18O
Molecular Weight	166.26
XLogP	3.3
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Heavy Atom Count	12
Formal Charge	0
Complexity	179

SMILES

CCCCC/C=C/1\CCCC1=O

InChI

InChI=1S/C11H18O/c1-2-3-4-5-7-10-8-6-9-11(10)12/h7H,2-6,8-9H2,1H3/b10-7+

InChIKey

WZPGQHVPSKTELT-JXMROGBWSA-N

Chemical Structure

2D Structure

CAS: 17373-89-6

CID: 6385721

Formula: C11H18O

MW: 166.26

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	166.26
XLogP3	3.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Exact Mass	166.135765193
Monoisotopic Mass	166.135765193
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	179
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-474673	2-[2- (2,2,2-Trifluoroethoxy) phenoxy]-ethanol
sc-343302	2,2,2-trifluoroethyl 2-furylmethylcarbamate
sc-497106	2,2-Diphenyl-2,2-cyclohexanone
sc-334773	2- (2,2,2-trifluoroethoxy) isonicotinonitrile
sc-334771A	2- (2,2,2-trifluoroethoxy) cyclohexanamine
sc-259156	2- (2,2,2-Trifluoroethoxy) ethanol
sc-322118	2'-Methoxy-2,2,2-trifluoroacetophenone
sc-334770	2- (2,2,2-trifluoroethoxy) aniline
sc-334770A	2- (2,2,2-trifluoroethoxy) aniline
sc-238236A	2,2,2-Trifluoroacetophenone

Catalog	Name
TRC-H296550-50MG	2-Hexylidenecyclopentanone
TRC-H296553-1G	(2E)-2-Hexylidenecyclopentanone
TRC-H396553-100MG	(2Z)-2-Hexylidenecyclopentanone
TRC-H296552-25MG	2-Hexylidenecyclopentanone-d4
PC1003049-01	2,2,2-Trifluoroethyl 2,2,2-trichloroacetate
H 038-005	2'- , 2''-, 2''', 2'''', 2''''', 2''''''- Hexadeoxy- 2'-, 2'', 2''', 2'''', 2''''', 2''''''- hexafluoro- cyclic hexaadenosine monophosphate (2',2'',2''',2'''',2''''',2''''''-Hexa-F-c-hexadAMP / cFA6), sodium salt
OR1009873-01	2,2,2,2-Ethylenedinitrilotetraethanol
PC32719-01	2,2,2,2'-Tetrafluoroacetophenone
TRC-T790200-50MG	2,2,2-Trifluoroethyl 2,5-Bis(2,2,2-trifluoroethoxy)benzoate
MBS6106553-01	2,2,2-Trifluoroethyl 2-Hydroxy-5-(2,2,2-trifluoroethoxy)benzoate