AG00EFCP

6433-72-3 | Ethyl 2-Aminoindole-3-carboxylate

AG00EFCP

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CAS Number	6433-72-3
Catalog Number	AG00EFCP(AGN-PC-0K5R7A)
Chemical Name	Ethyl 2-Aminoindole-3-carboxylate
IUPAC Name	ethyl 2-amino-1H-indole-3-carboxylate
InChI	InChI=1S/C11H12N2O2/c1-2-15-11(14)9-7-5-3-4-6-8(7)13-10(9)12/h3-6,13H,2,12H2,1H3
InChI Key	KXEKODJGRSIGAU-UHFFFAOYSA-N
MDL Number	MFCD01568663
Molecular Formula	C11H12N2O2
Molecular Weight	204.2252
SMILES	O=C(C1=C(N)NC2=C1C=CC=C2)OCC
Synonyms	ethyl 2-amino-1H-indole-3-carboxylate, 6433-72-3, ETHYL 2-AMINOINDOLE-3-CARBOXYLATE, 1H-INDOLE-3-CARBOXYLIC ACID, 2-AMINO-, ETHYL ESTER, AC1LRS4L, Oprea1_549618, SCHEMBL7215720, KXEKODJGRSIGAU-UHFFFAOYSA-N, 2-AMINO-3-CARBETHOXYINDOLE, ZINC1388832, MFCD01568663, STK107678, AKOS022647945, Ethyl-2-amino-1H-indol-3-carboxyate, AB09233, KS-00000G63, AJ-25477, AK326655, aminoindole-3-carboxylic acid ethyl ester, CS-0037019, FT-0668145, 2-Aminoindole-3-carboxylic Acid, Ethyl Ester, 2-AMINO-1H-INDOLE-3-CARBOXYLIC ACID ETHYL ESTER, Z2230861965, InChI=1/C11H12N2O2/c1-2-15-11(14)9-7-5-3-4-6-8(7)13-10(9)12/h3-6,13H,2,12H2,1H, ZINC01388832, CID1476606,

Complexity	245
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	204.09g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	204.229g/mol
Monoisotopic Mass	204.09g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	68.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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