2-(Boc-aminomethyl)phenylacetic acid

Base Information

Chemical Name:2-(Boc-aminomethyl)phenylacetic acid
CAS No.:40851-66-9
Molecular Formula:C14H19NO4
Molecular Weight:265.309
Hs Code.:29225090
European Community (EC) Number:637-014-7
DSSTox Substance ID:DTXSID80373143
Nikkaji Number:J2.426.517J
Wikidata:Q72448203
Mol file:40851-66-9.mol

Synonyms:40851-66-9;2-(BOC-AMINOMETHYL)PHENYLACETIC ACID;2-(2-(((tert-Butoxycarbonyl)amino)methyl)phenyl)acetic acid;BOC-2-AMINOMETHYL-PHENYLACETIC ACID;2-[2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]acetic Acid;2-(2-(N-BOC-AMINOMETHYL)PHENYL)ACETIC ACID;MFCD06656428;BENZENEACETIC ACID, 2-[[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]METHYL]-;2-[2-({[(tert-butoxy)carbonyl]amino}methyl)phenyl]acetic acid;2-(Boc-aminomethyl)phenylaceticAcid;2-(2-((tert-butoxycarbonylamino)methyl)phenyl)acetic acid;SCHEMBL825511;(2-{[(tert-butoxycarbonyl)amino]methyl}phenyl)acetic acid;DTXSID80373143;CGPQRFCFBISLKF-UHFFFAOYSA-N;BCP21715;AB3116;Boc-(2-aminomethylphenyl)acetic acid;AKOS015891415;AS-44687;SY004133;CS-0067868;FT-0639675;EN300-112336;2-(Boc-aminomethyl)phenylacetic acid, >=99.0%;2-(tert-butoxycarbonylaminomethyl)phenylacetic acid;2-(tert-Butoxycarbonylaminomethyl)benzeneacetic acid;[2-(tert-butoxycarbonylamino-methyl)-phenyl]-acetic acid

Suppliers and Price of 2-(Boc-aminomethyl)phenylacetic 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

Acrotein
2-[(Boc-amino)methyl]benzeneaceticacid 97%
5g
$ 354.93

Activate Scientific
2-(Boc-aminomethyl)phenylacetic Acid 97+%
5 g
$ 371.00

Activate Scientific
2-(Boc-aminomethyl)phenylacetic Acid 97+%
250 mg
$ 77.00

Activate Scientific
2-(Boc-aminomethyl)phenylacetic Acid 97+%
1 g
$ 134.00

AHH
Boc-2-Aminomethyl-phenylaceticacid 98%
50g
$ 310.00

AK Scientific
2-(2-(((tert-Butoxycarbonyl)amino)methyl)phenyl)aceticacid
1g
$ 146.00

Alichem
2-(2-(((tert-Butoxycarbonyl)amino)methyl)phenyl)aceticacid
5g
$ 428.00

American Custom Chemicals Corporation
2-(TERT-BUTOXYCARBONYLAMINO-METHYL)-PHENYL-ACETIC ACID 95.00%
1G
$ 1004.85

American Custom Chemicals Corporation
2-(TERT-BUTOXYCARBONYLAMINO-METHYL)-PHENYL-ACETIC ACID 95.00%
5G
$ 2328.48

Biosynth Carbosynth
Boc-2-aminomethyl-phenylacetic acid
2 g
$ 450.00

Total 49 raw suppliers

Chemical Property of 2-(Boc-aminomethyl)phenylacetic acid

Chemical Property:

Vapor Pressure:2.4E-08mmHg at 25°C
Refractive Index:1.533
Boiling Point:435.2 °C at 760 mmHg
PKA:4.26±0.10(Predicted)
Flash Point:217 °C
PSA：75.63000
Density:1.163 g/cm³
LogP:2.72930
Storage Temp.:under inert gas (nitrogen or Argon) at 2–8 °C
XLogP3:1.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:265.13140809
Heavy Atom Count:19
Complexity:322

Purity/Quality:

99% ^*data from raw suppliers

2-[(Boc-amino)methyl]benzeneaceticacid 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn
Hazard Codes:Xn
Statements: 22-36
Safety Statements: 36

MSDS Files:

Useful:

Canonical SMILES:CC(C)(C)OC(=O)NCC1=CC=CC=C1CC(=O)O
Uses [2-(tert-Butoxycarbonylaminomethyl)phenyl]acetic Acid is used to study molecular modeling on oligomers built from 2-aminomethylphenylacetic acid.

Technology Process of 2-(Boc-aminomethyl)phenylacetic acid

There total 8 articles about 2-(Boc-aminomethyl)phenylacetic 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: 98.0%

: 147410-31-9
methyl 2-(N-(tert-butoxycarbonyl)aminomethyl)phenylacetate

: 40851-66-9
2-(tert-butoxycarbonylaminomethyl)phenylacetic acid

Guidance literature:: With lithium hydroxide; In tetrahydrofuran; water; at 20 ℃;

Reference yield: 88.1%

: 24424-99-5
di-tert-butyl dicarbonate

: 40851-65-8
2-Aminomethylphenylacetic acid

: 40851-66-9
2-(tert-butoxycarbonylaminomethyl)phenylacetic acid

Guidance literature:: With water; In 1,4-dioxane; at 0 - 20 ℃; for 3.16667h;
DOI:10.1007/s11164-013-1069-4

Reference yield:

: 18698-97-0
ortho-bromophenylacetic acid

: 40851-66-9
2-(tert-butoxycarbonylaminomethyl)phenylacetic acid

Guidance literature:: Multi-step reaction with 5 steps

1: H₂SO₄ / Heating

2: dimethylformamide / Heating

3: H₂; aq. HCl / Pd/C / methanol / 25 °C / 3620.04 Torr

4: Et₃N / tetrahydrofuran / 25 °C

5: aq. LiOH / tetrahydrofuran / 25 °C

With hydrogenchloride; lithium hydroxide; sulfuric acid; hydrogen; triethylamine; palladium on activated charcoal; In tetrahydrofuran; methanol; N,N-dimethyl-formamide;
DOI:10.1016/j.bmcl.2005.03.020