Cas no 62754-26-1 (tert-butyl 3,4-diaminobenzoate)

Tert-butyl 3,4-diaminobenzoate is a versatile aromatic ester derivative featuring both amine functional groups and a tert-butyl ester moiety. This compound is particularly valuable in organic synthesis and pharmaceutical applications due to its dual reactivity, enabling use as a building block for heterocycles, polymers, and active pharmaceutical intermediates. The tert-butyl group enhances solubility in organic solvents while providing steric protection for the ester functionality. The adjacent amino groups allow for further functionalization, such as diazotization or condensation reactions. Its stability under various conditions makes it suitable for multi-step synthetic routes. The compound is commonly employed in the development of dyes, agrochemicals, and specialty materials requiring precise aromatic substitution patterns.
tert-butyl 3,4-diaminobenzoate structure
62754-26-1 structure
Product Name:tert-butyl 3,4-diaminobenzoate
CAS No:62754-26-1
MF:C11H16N2O2
MW:208.256942749023
MDL:MFCD20039955
CID:432494
PubChem ID:14891903
Update Time:2025-06-07

tert-butyl 3,4-diaminobenzoate Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid, 3,4-diamino-, 1,1-dimethylethyl ester
    • tert-butyl 3,4-diaminobenzoate
    • DTXSID50565033
    • tert-butyl3,4-diaminobenzoate
    • SB78146
    • CS-0253361
    • MFCD20039955
    • 3,4-diamino-benzoic acid tert-butyl ester
    • EN300-640690
    • 62754-26-1
    • SCHEMBL11090176
    • MDL： MFCD20039955
    • Inchi： 1S/C11H16N2O2/c1-11(2,3)15-10(14)7-4-5-8(12)9(13)6-7/h4-6H,12-13H2,1-3H3
    • InChI Key： PSXWMTJULZJDAI-UHFFFAOYSA-N
    • SMILES： O(C(C1C=CC(=C(C=1)N)N)=O)C(C)(C)C

Computed Properties

  • Exact Mass: 208.12128
  • Monoisotopic Mass: 208.121177757g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 3
  • Complexity: 235
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.5
  • Topological Polar Surface Area: 78.3?2

Experimental Properties

  • PSA: 78.34

tert-butyl 3,4-diaminobenzoate Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Alichem
A019100586-250mg
Tert-butyl 3,4-diaminobenzoate
 62754-26-1 95%
250mg
 $449.08 2023-09-01
Alichem
A019100586-1g
Tert-butyl 3,4-diaminobenzoate
 62754-26-1 95%
1g
 $1057.30 2023-09-01
TRC
B789753-5mg
tert-butyl 3,4-diaminobenzoate
 62754-26-1
5mg
 $ 50.00 2022-06-06
TRC
B789753-10mg
tert-butyl 3,4-diaminobenzoate
 62754-26-1
10mg
 $ 70.00 2022-06-06
TRC
B789753-50mg
tert-butyl 3,4-diaminobenzoate
 62754-26-1
50mg
 $ 295.00 2022-06-06
abcr
AB444354-
tert-Butyl 3,4-diaminobenzoate, min. 95%; .
 62754-26-1
€738.20 2022-08-31
eNovation Chemicals LLC
Y1249955-250mg
tert-butyl 3,4-diaMinobenzoate
 62754-26-1 95%
250mg
 $775 2024-06-06
eNovation Chemicals LLC
Y1249955-1g
tert-butyl 3,4-diaMinobenzoate
 62754-26-1 95%
1g
 $1830 2024-06-06
Enamine
EN300-640690-0.05g
tert-butyl 3,4-diaminobenzoate
 62754-26-1 95.0%
0.05g
 $226.0 2025-03-15
Enamine
EN300-640690-0.1g
tert-butyl 3,4-diaminobenzoate
 62754-26-1 95.0%
0.1g
 $337.0 2025-03-15

tert-butyl 3,4-diaminobenzoate Related Literature

Related Categories

62754-26-1 (tert-butyl 3,4-diaminobenzoate) Related Products

Recommended suppliers
Zhengzhou Baoyu Pharmaceutical Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Zhengzhou Baoyu Pharmaceutical Co., Ltd.
Wuhan ChemNorm Biotech Co.,Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Wuhan ChemNorm Biotech Co.,Ltd.
Yunnanjiuzhen
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Yunnanjiuzhen
Hubei Cuiyuan Biotechnology Co.,Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Hubei Cuiyuan Biotechnology Co.,Ltd
ASIACHEM I&E (JIANGSU) CO., LTD
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
ASIACHEM I&E (JIANGSU) CO., LTD