CCOC(=O)C1=CC2=CC=CC=C2N1
CAS: 3770-50-1
Name: ethyl 1H-indole-2-carboxylate
SMILES: CCOC(=O)C1=CC2=CC=CC=C2N1

Molecular Processing

Molecular formula
C11H11NO2
Molecular weight
189.21
Exact mass
189.079
XLogP
2.34
TPSA
42.09
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
14
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.182
Molar refractivity
54.26

Supplementary Information

InChIKey: QQXQAEWRSVZPJM-UHFFFAOYSA-N
Synonyme
Ethyl indole-2-carboxylateEthyl 1H-indole-2-carboxylate2-CarbethoxyindoleIndole-2-carboxylic acid, ethyl ester1H-Indole-2-carboxylic acid ethyl ester2-EthoxycarbonylindoleWR9Y4AXI3QEINECS 223-206-4UNII-WR9Y4AXI3QNSC 10076NSC-10076DTXSID60191140RefChem:138956DTXCID70113631Indole-2-carboxylic acid, ethyl ester (8CI)223-206-4InChI=1/C11H11NO2/c1-2-14-11(13)10-7-8-5-3-4-6-9(8)12-10/h3-7,12H,2H2,1HQQXQAEWRSVZPJM-UHFFFAOYSA-N3770-50-1Indole-2-carboxylic acid ethyl ester1H-Indole-2-carboxylic acid, ethyl esterMFCD00005609ETHYLINDOLE-2-CARBOXYLATENSC10076ETHYL 2-INDOLECARBOXYLATE1H-INDOLE-2-CARBOXYLIC ACID,ETHYL ESTER2-carboethoxyindole2-Carboethoxy-indoleethyl-2-indolecarboxylateMaybridge3_005325
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