2-Ethylindole

CAT: 0127-OR930314-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR930314-01Size:100 mg

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CAS Number

3484-18-2

MDL Number

MFCD00049343

Purity

97%

Smiles

CCc1cc2ccccc2[nH]1

Chemical Information

2-ethyl-1H-indole

CAS Number	3484-18-2
PubChem CID	3801618
IUPAC Name	2-ethyl-1H-indole
Molecular Formula	C10H11N
Molecular Weight	145.20
XLogP	3
Topological Polar Surface Area	15.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Heavy Atom Count	11
Formal Charge	0
Complexity	133

SMILES

CCC1=CC2=CC=CC=C2N1

InChI

InChI=1S/C10H11N/c1-2-9-7-8-5-3-4-6-10(8)11-9/h3-7,11H,2H2,1H3

InChIKey

BWNBLGQCCSCCHF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 3484-18-2

CID: 3801618

Formula: C10H11N

MW: 145.20

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	145.20
XLogP3	3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Exact Mass	145.089149355
Monoisotopic Mass	145.089149355
Topological Polar Surface Area	15.8 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	133
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
OR1011869-01	5-Ethylindole
OR5162-01	7-Ethylindole
OR904579-01	5-Ethylindole-2-carboxylic acid
OR83544-01	5-Ethylindolin-2-one
OR1067495-01	5-Ethylindoline-2,3-dione
OR1100460-01	4-Ethylindoline-2,3-dione
OR1063255-01	1-Ethylindoline-2,3-dione
OR1061096-01	5-Chloro-1-ethylindolin-2-one
OR1054667	3-Ethynylindole
OR55065	1-Ethylindene

Catalog	Name
sc-479333	2-Ethylindole
230314-01	2-Ethylindole ≥97%
269937-01	2-Carbethoxy-5-ethylindole
275711-01	5-Ethylindole
FE52303-01	7-Ethylindole
FE30373-01	5-Ethylindole-2-carboxylic acid
234164-01	5-Ethylindole 98+%
230070-01	2-Carbethoxy-5-ethylindole 98+% (GC)
sc-281500A	7-Ethylindole-3-carboxaldehyde
sc-280500A	5-Ethylindole-3-acetic acid