Rac-Etomidate

CAT: 1596-AR-E10738-02Size: 25 UnitsDry Ice: NoHazardous: No

1 / 1

CAT#:1596-AR-E10738-02Size:25 Units

Selected

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

Quick Request Actions

CAS Number

15301-65-2

Synonyms

Ethyl 1- (1-phenylethyl) -1H-imidazole-5-carboxylate; Etomidate Racemate

Molecular Formula

C14H16N2O2

Molecular Weight

244.29

API Name

Etomidate

Chemical Information

Ethnor

3-(1-phenylethyl)-4-imidazolecarboxylic acid ethyl ester is a member of imidazoles.

CAS Number	15301-65-2
PubChem CID	36339
IUPAC Name	ethyl 3-(1-phenylethyl)imidazole-4-carboxylate
Molecular Formula	C14H16N2O2
Molecular Weight	244.29
XLogP	3
Topological Polar Surface Area	44.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Heavy Atom Count	18
Formal Charge	0
Complexity	277

SMILES

CCOC(=O)C1=CN=CN1C(C)C2=CC=CC=C2

InChI

InChI=1S/C14H16N2O2/c1-3-18-14(17)13-9-15-10-16(13)11(2)12-7-5-4-6-8-12/h4-11H,3H2,1-2H3

InChIKey

NPUKDXXFDDZOKR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 15301-65-2

CID: 36339

Formula: C14H16N2O2

MW: 244.29

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	244.29
XLogP3	3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Exact Mass	244.121177757
Monoisotopic Mass	244.121177757
Topological Polar Surface Area	44.1 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	277
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes