(1S)-1-Amino-5-phosphono-2,3-dihydro-1H-indene-1-carboxylic acid

Base Information

Chemical Name:(1S)-1-Amino-5-phosphono-2,3-dihydro-1H-indene-1-carboxylic acid
CAS No.:220029-96-9
Molecular Formula:C₁₀H₁₂NO₅P
Molecular Weight:257.183
Hs Code.:
DSSTox Substance ID:DTXSID40473219
Nikkaji Number:J1.060.501F
Wikidata:Q82302486
Mol file:220029-96-9.mol

Synonyms:220029-96-9;(S)-APIC;(1S)-1-amino-5-phosphono-2,3-dihydroindene-1-carboxylic acid;(1S)-1-Amino-5-phosphono-2,3-dihydro-1H-indene-1-carboxylic acid;1H-Indene-1-carboxylicacid, 1-amino-2,3-dihydro-5-phosphono-, (1S)-;1(S)-AMINO-5-PHOSPHONOINDAN-1-CARBOXYLIC ACID;SCHEMBL2799888;DTXSID40473219;(s)-1-amino-5-phosphonoindancarboxylic acid;(1S)-1-amino-5-phosphono-2, 3-dihydroindene-1-carboxylic acid;(S)-1-amino-5-phosphono-2,3-dihydro-1H-indene-1-carboxylic acid

Suppliers and Price of (1S)-1-Amino-5-phosphono-2,3-dihydro-1H-indene-1-carboxylic acid

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

American Custom Chemicals Corporation
1(S)-AMINO-5-PHOSPHONOINDAN-1-CARBOXYLIC ACID 98.00%
5MG
$ 504.20

Total 8 raw suppliers

Chemical Property of (1S)-1-Amino-5-phosphono-2,3-dihydro-1H-indene-1-carboxylic acid

Chemical Property:

PSA：130.66000
LogP:0.37470
XLogP3:-3.5
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:257.04530948
Heavy Atom Count:17
Complexity:381

Purity/Quality:

97% ^*data from raw suppliers

1(S)-AMINO-5-PHOSPHONOINDAN-1-CARBOXYLIC ACID 98.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1CC(C2=C1C=C(C=C2)P(=O)(O)O)(C(=O)O)N
Isomeric SMILES:C1C[C@](C2=C1C=C(C=C2)P(=O)(O)O)(C(=O)O)N

Technology Process of (1S)-1-Amino-5-phosphono-2,3-dihydro-1H-indene-1-carboxylic acid

There total 14 articles about (1S)-1-Amino-5-phosphono-2,3-dihydro-1H-indene-1-carboxylic acid which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 80.0%

: 865172-73-2
C₃₁H₃₅N₂O₉P

: 220029-96-9
(S)-1-amino-5-phosphonoindan-1-carboxylic acid

Guidance literature:: Multistep reaction;
DOI:10.1021/ol0512942

Reference yield:

: 701232-87-3
(5-bromo-2,3-dihydro-1H-inden-1-ylidene)methyl methyl ether

: 220029-96-9
(S)-1-amino-5-phosphonoindan-1-carboxylic acid

Guidance literature:: Multi-step reaction with 4 steps

1.1: 75 percent / (R)-proline / acetonitrile / 4 h

2.1: NaH₂PO₄; 2-methyl-2-butene; NaClO₂ / 2-methyl-propan-2-ol; H₂O; tetrahydrofuran / 12 h / 4 °C

2.2: 81 percent / toluene; methanol; diethyl ether

3.1: 74 percent / triethylamine / Pd(PPh₃)4 / toluene / 72 h / 115 °C

With sodium chlorite; sodium dihydrogenphosphate; 2-methyl-but-2-ene; triethylamine; D-Prolin; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In tetrahydrofuran; water; toluene; acetonitrile; tert-butyl alcohol;
DOI:10.1021/ol0512942

Reference yield:

: 865172-71-0
(S)-methyl 1-formyl-1-[1,2-hydrazinedicarboxylic acid-bis(phenylmethyl)ester]-2,3-dihydro-1H-indene-5-carboxylate

: 220029-96-9
(S)-1-amino-5-phosphonoindan-1-carboxylic acid

Guidance literature:: Multi-step reaction with 3 steps

1.1: NaH₂PO₄; 2-methyl-2-butene; NaClO₂ / 2-methyl-propan-2-ol; H₂O; tetrahydrofuran / 12 h / 4 °C

1.2: 81 percent / toluene; methanol; diethyl ether

2.1: 74 percent / triethylamine / Pd(PPh₃)4 / toluene / 72 h / 115 °C

With sodium chlorite; sodium dihydrogenphosphate; 2-methyl-but-2-ene; triethylamine; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In tetrahydrofuran; water; toluene; tert-butyl alcohol;
DOI:10.1021/ol0512942