AG003QDH

27034-51-1 | Ethyl 6-chloroindole-2-carboxylate

AG003QDH

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CAS Number	27034-51-1
Catalog Number	AG003QDH(AGN-PC-0LW6GM)
Chemical Name	Ethyl 6-chloroindole-2-carboxylate
IUPAC Name	ethyl 6-chloro-1H-indole-2-carboxylate
InChI	InChI=1S/C11H10ClNO2/c1-2-15-11(14)10-5-7-3-4-8(12)6-9(7)13-10/h3-6,13H,2H2,1H3
InChI Key	FSMZLIBWSAMADK-UHFFFAOYSA-N
MDL Number	MFCD03084731
Molecular Formula	C11H10ClNO2
Molecular Weight	223.6556
SMILES	O=C(C(N1)=CC2=C1C=C(Cl)C=C2)OCC
Synonyms	27034-51-1, Ethyl 6-Chloroindole-2-carboxylate, 6-chloroindole-2-carboxylic acid Ethyl ester, ethyl 6-chloro-1H-indole-2-carboxylate, 6-Chloro-2-Indolecarboxylic methyl ester, CHEMBL3622748, 6-chloro-1H-indole-2-carboxylic acid ethyl ester, MFCD03084731, 1H-Indole-2-carboxylic acid, 6-chloro-, ethyl ester, PubChem1672, SCHEMBL615882, CTK1A1838, DTXSID80426709, FSMZLIBWSAMADK-UHFFFAOYSA-N, ethyl 6-chloroindole-2 carboxylate, Ethyl-6-chloroindole-2-carboxylate, ACN-S004168, ACT02496, BCP27404, ZINC2506068, ANW-50476, BDBM50123680, CE-166, SBB066639, AKOS009290670, AC-7286, CS-W005122, FS-2414, MB02586, RP05305, TRA0070193, VI30023, AJ-36099, AK-29970, BC225103, BR-29970, CJ-08475, EN000549, N503, SC-03031, SY005486, ethyl 6-chloranyl-1H-indole-2-carboxylate, 6-chlorindole-2-carboxylic acid ethyl ester, AB0015828, AB1000494, DB-005392, ST2413057, TL8002177, TR-012202, AM20080884, FT-0080990, FT-0601330, 6-chloro indole-2-carboxylic acid ethyl ester, M-1920, MFCD03084731 (97+%), 034C511, A845804, AP-283/40634148, I10-0100, J-016653, J-521182, null, C11H10ClNO2, RW1541, ZINC02506068, CID7015027, 98081-84-6,

Complexity	247
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	223.04g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	223.656g/mol
Monoisotopic Mass	223.04g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	42.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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