tert-Butyl 4-aminobenzoate 98% supplier in China CAS NO.18144-47-3

we have 3 OEM factories, 2 R&D labs. Aily is striving to improve reseach and development, meet social and customers needs with a unifying strategic idea.

1. Introduction of tert-Butyl 4-aminobenzoate

The tert-Butyl 4-aminobenzoate, with its CAS NO 18144-47-3, is a kind of pink crystalline powder. It has synonyms of Benzoicacid, p-amino-, tert-butyl ester (7CI,8CI);1,1-Dimethylethyl 4-aminobenzoate;4-Aminobenzoic acid 1,1-dimethylethyl ester;4-Aminobenzoic acid tert-butylester;4-Aminobenzoic acid tert-butyl ester;NSC 31647;p-Aminobenzoic acidtert-butyl ester;tert-Butyl p-aminobenzoate and tert-Butyl 4-aminobenzoate.
 

2. Properties of tert-Butyl 4-aminobenzoate

Molecular Weight 193.2423 [g/mol]
Molecular Formula C11H15NO2
XLogP3-AA 2.1
H-Bond Donor 1
H-Bond Acceptor 3
Rotatable Bond Count 3
Tautomer Count 3
Exact Mass 193.110279
MonoIsotopic Mass 193.110279
Topological Polar Surface Area 52.3
Heavy Atom Count 14 
Complexity 200
Covalently-Bonded Unit Count 1
Feature 3D Acceptor Count 1
Feature 3D Donor Count 1
Feature 3D Cation Count 1
Feature 3D Hydrophobe Count 1
Feature 3D Ring Count 1
Effective Rotor Count 3
Conformer Sampling RMSD 0.6
CID Conformer Count 8
 

3. Structure descriptors of tert-Butyl 4-aminobenzoate

IUPAC Name: tert-butyl 4-aminobenzoate

InChI: InChI=1S/C11H15NO2/c1-11(2,3)14-10(13)8-4-6-9(12)7-5-8/h4-7H,12H2,1-3H3

InChIKey: KYORUZMJUKHKFS-UHFFFAOYSA-N

Canonical SMILES : CC(C)(C)OC(=O)C1=CC=C(C=C1)N