AG003UJA

64113-91-3 | tert-butyl 2-aminobenzoate

AG003UJA

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CAS Number	64113-91-3
Catalog Number	AG003UJA(AGN-PC-0KU9XD)
Chemical Name	tert-butyl 2-aminobenzoate
IUPAC Name	tert-butyl 2-aminobenzoate
InChI	InChI=1S/C11H15NO2/c1-11(2,3)14-10(13)8-6-4-5-7-9(8)12/h4-7H,12H2,1-3H3
InChI Key	HDXMPGOKFMBDHJ-UHFFFAOYSA-N
MDL Number	MFCD03095523
Molecular Formula	C11H15NO2
Molecular Weight	193.2423
SMILES	CC(C)(C)OC(=O)C1=C(N)C=CC=C1
Synonyms	tert-Butyl 2-aminobenzoate, 64113-91-3, tert-Butyl anthranilate, HDXMPGOKFMBDHJ-UHFFFAOYSA-N, 2-aminobenzoic acid tert-butyl ester, Benzoic acid, 2-amino-, 1,1-dimethylethyl ester, t-butyl 2-aminobenzoate, AC1MP6NT, ACMC-20a5j1, tert-butyl 2-azanylbenzoate, SCHEMBL171563, 1,1-dimethylethyl aminobenzoate, CTK3J0133, DTXSID10392403, 1,1-dimethylethyl 2-aminobenzoate, 2-amino benzoic acid t-butyl ester, KS-00000K6C, ZINC2384239, Anthranilic acid, tert.-butyl ester, 9818AB, AB1268, ANW-58091, MFCD03095523, 2-amino-benzoic acid tert-butyl ester, AKOS010135391, TRA0053282, VZ35879, tert-Butyl 2-aminobenzoate, >=97.0%, AJ-35085, AN-38869, DA-41822, DS-18540, RT-004610, FT-0694876, X-1501, 113B913, A834644, I01-8797, Z1592032469, Butyl 2-aminobenzoate, C11H15NO2, TERT-BUTYL2-AMINOBENZOATE, CID3430448,

Complexity	208
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	193.11g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	193.246g/mol
Monoisotopic Mass	193.11g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	52.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317
Packing Group
Precautionary statements	P261-P280
UN Code

Certificate of Analysis

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