4-Aminobenzoic Acid-13C6

Base Information

Chemical Name:4-Aminobenzoic Acid-13C6
CAS No.:161406-19-5
Molecular Formula:C₇H₇NO₂
Molecular Weight:143.072
Hs Code.:
European Community (EC) Number:803-101-5
Mol file:161406-19-5.mol

Synonyms:4-Aminobenzoic Acid-13C6;161406-19-5;4-amino(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-triene-1-carboxylic acid;4-Aminobenzoic acid 13C6;HY-B1008S1;CS-CX-00352;CS-0312440;4-Aminobenzoic acid-(phenyl-13C6), >=99% 13C, >=99% (CP)

Suppliers and Price of 4-Aminobenzoic Acid-13C6

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

TRC
4-AminobenzoicAcid-13C6
1mg
$ 250.00

Medical Isotopes, Inc.
4-Aminobenzoicacid-13C6
50 mg
$ 1390.00

IsoSciences
4-Aminobenzoicacid-[13C6] ≥95%
500mg
$ 2065.00

IsoSciences
4-Aminobenzoicacid-[13C6] ≥95%
250mg
$ 1087.00

American Custom Chemicals Corporation
[1,2,3,4,5,6-13C6]-P-AMINOBENZOIC ACID 95.00%
5MG
$ 495.35

Total 6 raw suppliers

Chemical Property of 4-Aminobenzoic Acid-13C6

Chemical Property:

Melting Point:187 - 188 °C (H2O)
PSA：63.32000
LogP:1.54820
XLogP3:0.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:143.06780748
Heavy Atom Count:10
Complexity:128

Purity/Quality:

≥ 99% (CP); ≥ 99% atom 13C ^*data from raw suppliers

4-AminobenzoicAcid-13C6 ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC(=CC=C1C(=O)O)N
Isomeric SMILES:[13CH]1=[13CH][13C](=[13CH][13CH]=[13C]1C(=O)O)N
Uses Labelled p-Aminobenzoic Acid. Widely distributed in nature as a B complex factor. Baker’s yeast contains 5 to 6 ppm, brewer’s yeast from 10 to 100 ppm. Occurs free and in ester form.

Technology Process of 4-Aminobenzoic Acid-13C6

There total 2 articles about 4-Aminobenzoic Acid-13C6 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: 59.0%

: 233600-82-3
<1,2,3,4,5,6-(13)C6>-p-trifluoroacetamidobenzoic acid

: 161406-19-5
<1,2,3,4,5,6-(13)C6>-p-aminobenzoic acid

Guidance literature:: With sodium hydroxide; water; for 4h; Ambient temperature;

Reference yield:

: 233600-81-2
<1,2,3,4,5,6-(13)C6>-p-iodotrifluoroacetanilide

: 161406-19-5
<1,2,3,4,5,6-(13)C6>-p-aminobenzoic acid

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) n-BuLi / 1.) ether, hexane, -78 deg C, 2 h, 2.) ether, hexane, -78 deg C to r.t.

2: 59 percent / NaOH, H₂O / 4 h / Ambient temperature

With sodium hydroxide; n-butyllithium; water;

Reference yield:

: 161406-19-5
<1,2,3,4,5,6-(13)C6>-p-aminobenzoic acid

: <1',2',3',4',5',6'-(13)C6>folic acid

Guidance literature:: Multi-step reaction with 5 steps

1: 2.) Me₂NH*BH₃ / 1.) glacial acetic acid, r.t., 15 min, 2.) glacial acetic acid, r.t., 20 min; 60 deg C, 10 min

2: 68 percent / trifluoroacetic acid / 1.5 h / Heating

3: NEt₃ / dimethylformamide / 0.25 h / 5 °C

4: dimethylformamide / 72 h / Ambient temperature

5: 40 percent / NaOH, H₂O / 1.5 h / Heating

With sodium hydroxide; dimethylamine borane; water; triethylamine; In N,N-dimethyl-formamide; trifluoroacetic acid;