3-Chloro-4-pyrrolidinobenzoic acid

Base Information

Chemical Name:3-Chloro-4-pyrrolidinobenzoic acid
CAS No.:585517-09-5
Molecular Formula:C₁₁H₁₂ClNO₂
Molecular Weight:225.675
Hs Code.:2933990090
DSSTox Substance ID:DTXSID60406367
Mol file:585517-09-5.mol

Synonyms:3-chloro-4-pyrrolidinobenzoic acid;585517-09-5;3-chloro-4-pyrrolidin-1-ylbenzoic acid;3-Chloro-4-(pyrrolidin-1-yl)benzoic acid;3-CHLORO-4-(1-PYRROLIDINYL)BENZOIC ACID;MFCD02628415;3-Chloro-4-pyrrolidinobenzoicAcid;Oprea1_124914;SCHEMBL1398597;DTXSID60406367;ICTYJBKSXOEFEB-UHFFFAOYSA-N;AMY20276;AKOS000289325;AS-31652;SY006943;_x000D_3-Chloro-4-pyrrolidinobenzoic Acid;CS-0117586;FT-0761180;A869413;3-Chloro-4-pyrrolidin-1-ylbenzoic acid, AldrichCPR

Suppliers and Price of 3-Chloro-4-pyrrolidinobenzoic 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

TRC
3-Chloro--4-pyrrolidinobenzoicAcid
50mg
$ 45.00

Sigma-Aldrich
3-Chloro-4-pyrrolidin-1-ylbenzoic acid Aldrich
1g
$ 140.00

Crysdot
3-Chloro-4-pyrrolidin-1-ylbenzoic acid 97%
5g
$ 333.00

Crysdot
3-Chloro-4-pyrrolidin-1-ylbenzoic acid 97%
25g
$ 1045.00

Crysdot
3-Chloro-4-pyrrolidin-1-ylbenzoic acid 97%
10g
$ 556.00

Chemenu
3-Chloro-4-pyrrolidin-1-ylbenzoic acid 97%
25g
$ 978.00

Chemenu
3-Chloro-4-pyrrolidin-1-ylbenzoic acid 97%
5g
$ 311.00

Chemenu
3-Chloro-4-pyrrolidin-1-ylbenzoic acid 97%
10g
$ 520.00

ChemBridge Corporation
3-Chloro-4-pyrrolidin-1-ylbenzoic acid 95%
1 g
$ 70.00

American Custom Chemicals Corporation
3-CHLORO-4-PYRROLIDIN-1-YLBENZOIC ACID 95.00%
10G
$ 2771.14

Total 11 raw suppliers

Chemical Property of 3-Chloro-4-pyrrolidinobenzoic acid

Chemical Property:

Vapor Pressure:5.38E-07mmHg at 25°C
Boiling Point:396.4°C at 760 mmHg
Flash Point:193.5°C
PSA：40.54000
Density:1.339g/cm³
LogP:2.70340
Storage Temp.:Sealed in dry,Room Temperature
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:225.0556563
Heavy Atom Count:15
Complexity:241

Purity/Quality:

97% ^*data from raw suppliers

3-Chloro--4-pyrrolidinobenzoicAcid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi
Statements: 41
Safety Statements: 26-39

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CCN(C1)C2=C(C=C(C=C2)C(=O)O)Cl

Technology Process of 3-Chloro-4-pyrrolidinobenzoic acid

There total 2 articles about 3-Chloro-4-pyrrolidinobenzoic 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:

: 1072947-64-8
ethyl 3-chloro-4-(1-pyrrolidinyl)benzoate

: 585517-09-5
3-chloro-4-(pyrrolidin-1-yl)benzoic acid

Guidance literature:: ethyl 3-chloro-4-(1-pyrrolidinyl)benzoate; With sodium hydroxide; water; In ethanol; at 40 ℃; for 25h;

In water; ethyl acetate; pH=6; Acdification;

Reference yield:

: 585517-09-5
3-chloro-4-(pyrrolidin-1-yl)benzoic acid

Guidance literature:: With N-ethyl-N,N-diisopropylamine; In 1-methyl-pyrrolidin-2-one; at 90 ℃; for 9.5h;

With water; sodium hydroxide; In methanol; at 20 ℃;