1- (3-propylphenyl) ethanone

CAT: 0127-OR1093623-01Size: 250 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0127-OR1093623-01Size:250 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

717918-70-2

Purity

95%

Smiles

C1 (cccc (c1) CCC) C (=O) C

Chemical Information

1-(3-Propylphenyl)ethan-1-one

CAS Number	717918-70-2
PubChem CID	19777391
IUPAC Name	1-(3-propylphenyl)ethanone
Molecular Formula	C11H14O
Molecular Weight	162.23
XLogP	2.9
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Heavy Atom Count	12
Formal Charge	0
Complexity	151

SMILES

CCCC1=CC(=CC=C1)C(=O)C

InChI

InChI=1S/C11H14O/c1-3-5-10-6-4-7-11(8-10)9(2)12/h4,6-8H,3,5H2,1-2H3

InChIKey

UQWHVBJAAMMMPO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 717918-70-2

CID: 19777391

Formula: C11H14O

MW: 162.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	162.23
XLogP3	2.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Exact Mass	162.104465066
Monoisotopic Mass	162.104465066
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	151
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
OR1080229	2-chloro-1- (4-propylphenyl) ethanone
OR1094507-01	1- (2-methoxy-5-propylphenyl) ethanone
OR1063757-01	1- (2-Hydroxy-5-propylphenyl) ethanone
PC1012128-01	2,2-Difluoro-1- (4-propylphenyl) ethanone
PC1022523-01	2,2,2-trifluoro-1- (4-propylphenyl) ethanone
OR1097039-01	1- (4-propylphenyl) ethanol
PC1012144-01	2-chloro-2,2-difluoro-1- (4-propylphenyl) ethanone
OR1094531-01	1- (3-propylphenyl) propan-1-one
OR1100887-01	2-Methyl-1- (3-propylphenyl) -1-propanone
OR1088629-01	1- (4-Propylphenyl) -1-pentyn-3-ol

Catalog	Name
407683-01	1- (2,4-Dihydroxy-3-propylphenyl) ethanone
407583-01	1- (2-Hydroxy-4-mercapto-3-propylphenyl) ethanone
H946590	1-(2-Hydroxy-4-mercapto-3-propylphenyl)ethanone
sc-341680A	2-chloro-1-[2,5-dimethyl-1- (4-propylphenyl) -1H-pyrrol-3-yl]ethanone
CYB07700-01	1- (3,3-difluorocyclopentyl) -ethanone
sc-281805	1- (3-isopropoxyphenyl) ethanone
IRA35952-01	1- (3-Cyclopropylphenyl) ethanone
YGA15811-01	1- (3-Morpholinosulfonylphenyl) ethanone
RG-B212029-01	1- (3-Butoxyphenyl) Ethanone
RG-E141266-01	1- (3-Phenoxyphenyl) ethanone