AG01DTMM

1242140-62-0 | Ethyl 2-Amino-5-Bromo-1H-Indole-3-Carboxylate

AG01DTMM

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CAS Number	1242140-62-0
Catalog Number	AG01DTMM
Chemical Name	Ethyl 2-Amino-5-Bromo-1H-Indole-3-Carboxylate
IUPAC Name	ethyl 2-amino-5-bromo-1H-indole-3-carboxylate
InChI	InChI=1S/C11H11BrN2O2/c1-2-16-11(15)9-7-5-6(12)3-4-8(7)14-10(9)13/h3-5,14H,2,13H2,1H3
InChI Key	JEEONSIWPYAQME-UHFFFAOYSA-N
MDL Number	MFCD20226197
Molecular Formula	C11H11BrN2O2
Molecular Weight	283.1212
SMILES	NC=1NC2=CC=C(C=C2C1C(=O)OCC)Br
Synonyms	ethyl 2-amino-5-bromo-1H-indole-3-carboxylate, 1242140-62-0, CS-0062210, 2-Amino-5-bromo-1H-indole-3-carboxylic acid ethyl ester, 5-Bromo-2-amino-1H-indole-3-carboxylic acid ethyl ester,

Complexity	275
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	282g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	283.125g/mol
Monoisotopic Mass	282g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	68.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code	\N

Certificate of Analysis

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