Cas no 885953-27-5 (3-Methylpyrrolidine-3-carboxylic acid)

3-Methylpyrrolidine-3-carboxylic acid is a chiral pyrrolidine derivative featuring a carboxylic acid functional group at the 3-position and a methyl substituent on the same carbon. This compound serves as a versatile building block in organic synthesis, particularly for the preparation of pharmaceuticals and bioactive molecules. Its rigid pyrrolidine scaffold and stereocenter make it valuable for designing enantioselective catalysts or ligands. The carboxylic acid group allows for further functionalization via amidation, esterification, or other derivatization reactions. The compound’s structural features contribute to its utility in medicinal chemistry, where it may be incorporated into drug candidates to influence pharmacokinetic properties or target binding affinity.

3-Methylpyrrolidine-3-carboxylic acid structure

885953-27-5 structure

Product Name:3-Methylpyrrolidine-3-carboxylic acid

CAS No:885953-27-5

MF:C₆H₁₁NO₂

MW:129.157041788101

MDL:MFCD05663313

CID:890010

PubChem ID:3509091

Update Time:2025-05-28

3-Methylpyrrolidine-3-carboxylic acid Chemical and Physical Properties

Names and Identifiers

- 3-Methylpyrrolidine-3-carboxylic acid
- 3-METHYL-PYRROLIDINE-3-CARBOXYLIC ACID
- 3-methyl-3-pyrrolidinecarboxylic acid(SALTDATA: FREE)
- 3-Methyl-3-pyrrolidinecarboxylic acid (ACI)
- AS-47405
- CS-0091785
- F13601
- MFCD05663313
- JXNPHMVNQPDXQI-UHFFFAOYSA-N
- SCHEMBL1462801
- SY101588
- SY289205
- AKOS012442319
- EN300-68611
- MFCD24368648
- SY272046
- 3-methyl-3-pyrrolidine carboxylic acid
- DTXSID60393167
- SB39589
- 885953-27-5
- 3-methylpyrrolidine-3-carboxylicAcid
- DB-357243
- 3-METHYL-3-PYRROLIDINECARBOXYLIC ACID
- MFCD24368649
- MDL： MFCD05663313
- Inchi： 1S/C6H11NO2/c1-6(5(8)9)2-3-7-4-6/h7H,2-4H2,1H3,(H,8,9)
- InChI Key： JXNPHMVNQPDXQI-UHFFFAOYSA-N
- SMILES： O=C(C1(CCNC1)C)O

Computed Properties

Exact Mass: 129.078978594g/mol
Monoisotopic Mass: 129.078978594g/mol
Isotope Atom Count: 0
Hydrogen Bond Donor Count: 2
Hydrogen Bond Acceptor Count: 3
Heavy Atom Count: 9
Rotatable Bond Count: 1
Complexity: 135
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count : 1
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
XLogP3: -2.5
Topological Polar Surface Area: 49.3?2

3-Methylpyrrolidine-3-carboxylic acid Pricemore >>

Related Categories	No.	Product Name	Cas No.	Purity	Specification	Price	update time
Chemenu	CM275494-1g	3-Methylpyrrolidine-3-carboxylic acid	885953-27-5	95%	1g	$411	2021-08-18
Chemenu	CM275494-5g	3-Methylpyrrolidine-3-carboxylic acid	885953-27-5	95%	5g	$1234	2021-08-18
Enamine	EN300-68611-100mg	3-methylpyrrolidine-3-carboxylic acid	885953-27-5	95.0%	100mg	$107.0	2022-10-09
Enamine	EN300-68611-250mg	3-methylpyrrolidine-3-carboxylic acid	885953-27-5	95.0%	250mg	$153.0	2022-10-09
Enamine	EN300-68611-500mg	3-methylpyrrolidine-3-carboxylic acid	885953-27-5	95.0%	500mg	$240.0	2022-10-09
Enamine	EN300-68611-1000mg	3-methylpyrrolidine-3-carboxylic acid	885953-27-5	95.0%	1g	$309.0	2022-10-09
Enamine	EN300-68611-2500mg	3-methylpyrrolidine-3-carboxylic acid	885953-27-5	95.0%	2500mg	$571.0	2022-10-09
Enamine	EN300-68611-5000mg	3-methylpyrrolidine-3-carboxylic acid	885953-27-5	95.0%	5g	$1008.0	2022-10-09
Enamine	EN300-68611-10000mg	3-methylpyrrolidine-3-carboxylic acid	885953-27-5	95.0%	10g	$1853.0	2022-10-09
TRC	M341053-25mg	3-Methyl-3-pyrrolidinecarboxylic acid	885953-27-5		25mg	$ 70.00	2022-06-03

3-Methylpyrrolidine-3-carboxylic acid Production Method

Production Method 1

912444-75-8

885953-27-5

Reaction Conditions

1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Methanol ; 1 h, rt

Reference

Asymmetric synthesis and catalytic activity of 3-methyl-β-proline in enantioselective anti-Mannich-type reactions

Nagata, Kazuhiro; Kuga, Yasushi; Higashi, Akinori; Kinoshita, Atsushi; Kanemitsu, Takuya; et al, Journal of Organic Chemistry, 2013, 78(14), 7131-7136