Cas no 1260852-42-3 (tert-Butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate)

Tert-Butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate is a fluorinated pyrrolidine derivative commonly employed as a versatile intermediate in organic synthesis and pharmaceutical research. The presence of both a hydroxymethyl group and difluorinated carbons enhances its utility in constructing complex molecules, particularly in medicinal chemistry for the development of bioactive compounds. The tert-butyloxycarbonyl (Boc) protecting group ensures stability during synthetic transformations while allowing selective deprotection under mild acidic conditions. Its structural features, including the difluorinated pyrrolidine core, contribute to improved metabolic stability and bioavailability in drug candidates. This compound is particularly valuable in the synthesis of fluorinated analogs for probing structure-activity relationships.
tert-Butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate structure
1260852-42-3 structure
Product Name:tert-Butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate
CAS No:1260852-42-3
MF:C10H17F2NO3
MW:237.243690252304
MDL:MFCD12755195
CID:2094208
PubChem ID:57368644
Update Time:2025-11-06

tert-Butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate Chemical and Physical Properties

Names and Identifiers

    • tert-Butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate
    • 1-Boc-3,3-difluoro-4-(hydroxymethyl)pyrrolidine
    • 1260852-42-3
    • MFCD34566933
    • SY097947
    • EN300-6197461
    • (R)-(1-Boc-4,4-difluoro-3-pyrrolidinyl)methanol
    • Racemic-tert-butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate
    • 1-Pyrrolidinecarboxylic acid, 3,3-difluoro-4-(hydroxymethyl)-, 1,1-dimethylethyl ester
    • AS-33991
    • racemic-tert-butyl-3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate
    • CS-0048352
    • C10H17F2NO3
    • TERT-BUTYL3,3-DIFLUORO-4-(HYDROXYMETHYL)PYRROLIDINE-1-CARBOXYLATE
    • SY344426
    • DB-233433
    • 1-tert-butyloxycarbonyl-3,3-difluoro-4-hydroxymethylpyrrolidine
    • MFCD12755195
    • SCHEMBL17499881
    • SB11650
    • 2382120-13-8
    • AKOS025243151
    • MDL: MFCD12755195
    • Inchi: 1S/C10H17F2NO3/c1-9(2,3)16-8(15)13-4-7(5-14)10(11,12)6-13/h7,14H,4-6H2,1-3H3
    • InChI Key: OEMRLSZFXVVDLS-UHFFFAOYSA-N
    • SMILES: FC1(CN(C(=O)OC(C)(C)C)CC1CO)F

Computed Properties

  • Exact Mass: 237.11764973g/mol
  • Monoisotopic Mass: 237.11764973g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 276
  • 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: 1.1
  • Topological Polar Surface Area: 49.8?2

tert-Butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate Security Information

tert-Butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Chemenu
CM106322-100mg
tert-butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate
1260852-42-3 95%+
100mg
$341 2021-08-06
Chemenu
CM106322-250mg
tert-butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate
1260852-42-3 95%+
250mg
$569 2021-08-06
Chemenu
CM106322-1g
tert-butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate
1260852-42-3 95%+
1g
$1705 2021-08-06
Alichem
A109008588-100mg
tert-Butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate
1260852-42-3 95%
100mg
$610.05 2023-09-03
Alichem
A109008588-250mg
tert-Butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate
1260852-42-3 95%
250mg
$1013.70 2023-09-03
Alichem
A109008588-1g
tert-Butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate
1260852-42-3 95%
1g
$2278.50 2023-09-03
SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd.
Y10895-1g
tert-Butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate
1260852-42-3 95%
1g
¥16509.0 2024-07-18
SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd.
Y10895-250mg
tert-Butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate
1260852-42-3 95%
250mg
¥5259.0 2024-07-18
TRC
B947638-10mg
Tert-Butyl 3,3-Difluoro-4-(Hydroxymethyl)Pyrrolidine-1-Carboxylate
1260852-42-3
10mg
$ 50.00 2022-06-06
TRC
B947638-50mg
Tert-Butyl 3,3-Difluoro-4-(Hydroxymethyl)Pyrrolidine-1-Carboxylate
1260852-42-3
50mg
$ 65.00 2022-06-06

Additional information on tert-Butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate

tert-Butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate: A Comprehensive Overview

tert-Butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate (CAS No: 1260852-42-3) is a compound of significant interest in the field of organic chemistry and pharmaceutical research. This compound, with its unique structure and functional groups, has garnered attention for its potential applications in drug development and material science. In this article, we will delve into the properties, synthesis, applications, and recent advancements related to this compound.

The molecular structure of tert-butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate consists of a pyrrolidine ring substituted with a hydroxymethyl group at position 4 and two fluorine atoms at position 3. The tert-butyl group attached to the carboxylic acid moiety adds bulk to the molecule, potentially influencing its pharmacokinetic properties. This combination of functional groups makes the compound versatile for various chemical transformations.

Recent studies have highlighted the importance of fluorinated compounds in medicinal chemistry due to their unique electronic properties and bioavailability profiles. The presence of fluorine atoms in tert-butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate contributes to its stability and lipophilicity, making it a promising candidate for drug delivery systems. Researchers have explored its potential as a prodrug or intermediate in the synthesis of bioactive molecules.

The synthesis of tert-butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate involves multi-step organic reactions, including nucleophilic substitutions and ring-closing reactions. The use of transition metal catalysts has been reported to enhance the efficiency of these reactions, leading to higher yields and better purity. These advancements in synthetic methodology have made the compound more accessible for further research.

In terms of applications, tert-butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate has shown promise in the development of antiviral agents due to its ability to inhibit viral replication mechanisms. Additionally, its unique structure has been exploited in the design of polymerizable monomers for advanced materials with tailored mechanical properties.

The latest research on this compound has focused on its role in asymmetric synthesis and catalysis. Scientists have employed chiral catalysts to achieve enantioselective synthesis of this compound, paving the way for its use in chiral resolution studies. Furthermore, computational chemistry techniques have been utilized to predict its interaction with biological targets, providing insights into its therapeutic potential.

In conclusion, tert-butyl 3,3-difluoro-4-(hydroxymethyl)pyrrolidine-1-carboxylate is a multifaceted compound with diverse applications across various fields. Its unique chemical properties and recent advancements in synthesis and application underscore its importance in modern chemistry research.

Recommended suppliers
Wuhan ChemNorm Biotech Co.,Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Wuhan ChemNorm Biotech Co.,Ltd.
Suzhou Genelee Bio-Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Suzhou Genelee Bio-Technology Co., Ltd.
Hunan Well Medicine Synthesis Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Hunan Well Medicine Synthesis Technology Co., Ltd.
SHOCHEM(SHANGHAI) CO.,lTD
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
SHOCHEM(SHANGHAI) CO.,lTD
Hebei Liye chemical Co.,Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Hebei Liye chemical Co.,Ltd