AG001GSI

1416438-70-4 | 1H-Indole-4-carboxylic acid, 7-(trifluoromethyl)-, methyl ester

AG001GSI

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	1416438-70-4
Catalog Number	AG001GSI(AGN-PC-0JK1ID)
Chemical Name	1H-Indole-4-carboxylic acid, 7-(trifluoromethyl)-, methyl ester
IUPAC Name	methyl 7-(trifluoromethyl)-1H-indole-4-carboxylate
InChI	InChI=1S/C11H8F3NO2/c1-17-10(16)7-2-3-8(11(12,13)14)9-6(7)4-5-15-9/h2-5,15H,1H3
InChI Key	SBPMXPHJBULNNS-UHFFFAOYSA-N
MDL Number	MFCD22690546
Molecular Formula	C11H8F3NO2
Molecular Weight	243.1819
SMILES	O=C(C1=CC=C(C(F)(F)F)C2=C1C=CN2)OC
Synonyms	METHYL 7-(TRIFLUOROMETHYL)-1H-INDOLE-4-CARBOXYLATE, 1416438-70-4, methyl 7-(trifluoromethyl)-1H-indole-4-carboxylate, 97%, MFCD22690546, ZINC91692860, AKOS025146665, AK164623, AS-41317, SC-68618, AB0050295, methyl7-(trifluoromethyl)-1H-indole-4-carboxylate, 1H-Indole-4-carboxylic acid, 7-(trifluoromethyl)-, methyl ester,

Complexity	306
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	243.051g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	243.185g/mol
Monoisotopic Mass	243.051g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	42.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number