AG0069X7

98081-84-6 | Methyl 6-chloro-1H-indole-2-carboxylate

AG0069X7

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CAS Number	98081-84-6
Catalog Number	AG0069X7(AGN-PC-0LFZ6X)
Chemical Name	Methyl 6-chloro-1H-indole-2-carboxylate
IUPAC Name	methyl 6-chloro-1H-indole-2-carboxylate
InChI	InChI=1S/C10H8ClNO2/c1-14-10(13)9-4-6-2-3-7(11)5-8(6)12-9/h2-5,12H,1H3
InChI Key	HHDCCGVOJXWGEU-UHFFFAOYSA-N
MDL Number	MFCD04966992
Molecular Formula	C10H8ClNO2
Molecular Weight	209.6290
SMILES	O=C(C(N1)=CC2=C1C=C(Cl)C=C2)OC
Synonyms	methyl 6-chloro-1H-indole-2-carboxylate, 98081-84-6, 6-Chloro-1H-indole-2-carboxylic acid methyl ester, 6-CHLORO-2-METHOXYCARBONYLINDOLE, AC1NFWJ0, AC1Q43N8, SCHEMBL5917452, CTK3I6617, KS-00003RJB, DTXSID00405819, HHDCCGVOJXWGEU-UHFFFAOYSA-N, methyl 6-chloroindole-2-carboxylate, ZINC2534102, ANW-60966, BBL020717, KM3460, MFCD04966992, STK893407, AKOS000123958, AB20863, MCULE-9748232680, RP26523, RS-0324, AJ-38591, AB0076134, DB-016843, TC-149711, FT-0718165, EN300-68399, C57068, J-522542, 6-CHLORO-2-INDOLECARBOXYLIC ACID METHYL ESTER, ZINC02534102, CID4715032, Methyl6-chloro-1H-indole-2-carboxylate, 6-CHLORO-1H-INDOLE-2-CARBOXYLICACIDMETHYLESTER, 614-16-4,

Complexity	234
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	209.024g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	209.629g/mol
Monoisotopic Mass	209.024g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	42.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H317
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

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