tert-butyl 2-aminobenzoate

tert-butyl 2-aminobenzoate

CAS: 64113-91-3

Formula: C11H15NO2

SMILES: CC(C)(C)OC(=O)C1=CC=CC=C1N

IUPAC: 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

Composition: C (68.37%), H (7.82%), N (7.25%), O (16.56%)

Molar Mass: 193.246

Atom Count: 29

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	193.110278727
Formal Charge	0
FSP3	0.36
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	HDXMPGOKFMBDHJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	56.59
Topological Polar Surface Area	52.32
Polarizability	21.41
Ring Count	1
Rotatable Bond Count	3

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