AG00FWS8

74339-45-0 | Methyl 2-(5-chloro-1H-indol-3-yl)acetate

AG00FWS8

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CAS Number	74339-45-0
Catalog Number	AG00FWS8(AGN-PC-0WAN7T)
Chemical Name	Methyl 2-(5-chloro-1H-indol-3-yl)acetate
IUPAC Name	methyl 2-(5-chloro-1H-indol-3-yl)acetate
InChI	InChI=1S/C11H10ClNO2/c1-15-11(14)4-7-6-13-10-3-2-8(12)5-9(7)10/h2-3,5-6,13H,4H2,1H3
InChI Key	QLTNJBDKTUWQFP-UHFFFAOYSA-N
MDL Number	MFCD27923126
Molecular Formula	C11H10ClNO2
Molecular Weight	223.6556
SMILES	O=C(OC)CC1=CNC2=C1C=C(Cl)C=C2
Synonyms	Methyl 2-(5-chloro-1H-indol-3-yl)acetate, 74339-45-0, Methyl 5-Chloroindole-3-acetate, 1H-Indole-3-acetic acid, 5-chloro-, methyl ester, Methyl5-Chloroindole-3-acetate, SCHEMBL20769666, KS-00000BYD, DTXSID00858609, MFCD27923126, ZINC95929512, AKOS022176163, DS-7675, AC-29786, AK143438, Methyl (5-chloro-1H-indol-3-yl)acetate, SY048041, AJ-135497, AX8282700, CS-0041987, MFCD27923126 (95%), 5-Chloro-1H-indole-3-acetic acid methyl ester,

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	2.4

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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