Ethyl 2- (cyclohexylmethoxy) benzoate

CAT: 0127-OR1089339-01Size: 250 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0127-OR1089339-01Size:250 mg

Selected

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

Quick Request Actions

CAS Number

2739807-34-0

MDL Number

MFCD34648228

Purity

95%

Smiles

O (CC1CCCCC1) c1c (C (=O) OCC) cccc1

Chemical Information

Ethyl 2-(cyclohexylmethoxy)benzoate

CAS Number	2739807-34-0
PubChem CID	177685056
IUPAC Name	ethyl 2-(cyclohexylmethoxy)benzoate
Molecular Formula	C16H22O3
Molecular Weight	262.34
XLogP	4.5
Topological Polar Surface Area	35.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	6
Heavy Atom Count	19
Formal Charge	0
Complexity	271

SMILES

CCOC(=O)C1=CC=CC=C1OCC2CCCCC2

InChI

InChI=1S/C16H22O3/c1-2-18-16(17)14-10-6-7-11-15(14)19-12-13-8-4-3-5-9-13/h6-7,10-11,13H,2-5,8-9,12H2,1H3

InChIKey

QRELRCAXLGHRHK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2739807-34-0

CID: 177685056

Formula: C16H22O3

MW: 262.34

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	262.34
XLogP3	4.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	6
Exact Mass	262.15689456
Monoisotopic Mass	262.15689456
Topological Polar Surface Area	35.5 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	271
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
OR1091952-01	Methyl 2- (cyclohexylmethoxy) benzoate
PC3286-01	Ethyl 2- (trifluoromethyl) benzoate
PC1011080	Ethyl 2- (difluoromethyl) benzoate
OR1079843	Ethyl 2- (ethylthio) benzoate
OR936268-01	2- (Dimethylamino) ethyl benzoate
OR1047433-01	Ethyl 2- (diphenylphosphaneyl) benzoate
OR1093261	Ethyl 2- (benzyloxy) benzoate
OR1049954	Ethyl 2- (cyclopentylamino) benzoate
OR903561-01	Ethyl 2- (methylamino) benzoate
OR6441-01	Ethyl 2- (bromomethyl) benzoate

Catalog	Name
3122315	Ethyl benzoate
HY-W017439R-01	Ethyl benzoate (Standard)
E05290-01	Ethyl benzoate 98%
PDA86227-01	Ethyl 4- (hydrazinesulfonyl) benzoate
NBA44621-01	Ethyl 2- (ethylamino) benzoate
SBA26558-01	Ethyl 4- (ethylamino) benzoate
RG-E200814-01	Ethyl 4- (Dimethylamino) Benzoate
sc-279048	Ethyl 2- (ethoxycarbonylmethoxy) benzoate
sc-235031	(Ethyl benzoate) tricarbonylchromium (0)
sc-269094	Ethyl 3-trifluoromethyl-benzoate