AG00EFJB

65568-55-0 | Ethyl 2-amino-4-trifluoromethylbenzoate

AG00EFJB

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CAS Number	65568-55-0
Catalog Number	AG00EFJB(AGN-PC-0NKCBC)
Chemical Name	Ethyl 2-amino-4-trifluoromethylbenzoate
IUPAC Name	ethyl 2-amino-4-(trifluoromethyl)benzoate
InChI	InChI=1S/C10H10F3NO2/c1-2-16-9(15)7-4-3-6(5-8(7)14)10(11,12)13/h3-5H,2,14H2,1H3
InChI Key	RJKBQTRDYFUQQY-UHFFFAOYSA-N
MDL Number	MFCD08274771
Molecular Formula	C10H10F3NO2
Molecular Weight	233.1871
SMILES	NC1=C(C(=O)OCC)C=CC(=C1)C(F)(F)F
Synonyms	ETHYL 2-AMINO-4-TRIFLUOROMETHYLBENZOATE, 65568-55-0, ethyl 2-amino-4-(trifluoromethyl)benzoate, SCHEMBL11336074, CTK5C2887, DTXSID10510201, RJKBQTRDYFUQQY-UHFFFAOYSA-N, KS-00000P1X, ANW-49741, MFCD08274771, ZINC47202628, AKOS015920083, AS-9391, AK-65051, BR-65051, CJ-20559, SC-48943, AB0026088, AJ-110670, TC-138486, FT-0725046, ST24024840, W7681, 4-trifluoromethyl anthranilic acid ethyl ester, S-4790, C10H10F3NO2, ETHYL2-AMINO-4-TRIFLUOROMETHYLBENZOATE,

Complexity	255
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	233.066g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	233.19g/mol
Monoisotopic Mass	233.066g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	52.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.5

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

Lot Number