AG00CKY2

36779-16-5 | Ethyl 2-phenylindole-3-carboxylate

AG00CKY2

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CAS Number	36779-16-5
Catalog Number	AG00CKY2(AGN-PC-005TYO)
Chemical Name	Ethyl 2-phenylindole-3-carboxylate
IUPAC Name	ethyl 2-phenyl-1H-indole-3-carboxylate
InChI	InChI=1S/C17H15NO2/c1-2-20-17(19)15-13-10-6-7-11-14(13)18-16(15)12-8-4-3-5-9-12/h3-11,18H,2H2,1H3
InChI Key	PBOQSTKVCGVNDN-UHFFFAOYSA-N
MDL Number	MFCD04038610
Molecular Formula	C17H15NO2
Molecular Weight	265.3065
SMILES	O=C(C1=C(C2=CC=CC=C2)NC3=C1C=CC=C3)OCC
Synonyms	36779-16-5, Ethyl 2-phenyl-1H-indole-3-carboxylate, 2-Phenyl-1H-indole-3-carboxylic acid ethyl ester, Ethyl 2-phenylindole-3-carboxylate, ZINC2525385, 4040AJ, ACM36779165, AS-37575, Z-6124, C17H15NO2, CID11277085, ETHYL2-PHENYL-2,3-DIHYDRO-INDOLE-3-CARBOXYLATE,

Complexity	338
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	265.110279g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	265.31g/mol
Monoisotopic Mass	265.110279g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	42.1Ų
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H317
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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