(S)-3-Boc-Amino-Y-butyrolactone - ≥98% , CAS No.104227-71-6

CAS: 104227-71-6 Cat. No.: S189469 Molecular Weight: 201.22 EC Number: 829-021-0 PubChem CID: 10943528
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
(3S)-5-oxotetrahydro-3-furanylcarbamic acid tert-butyl ester | tert-butyl(3s)-5-oxotetrahydro-3-furanylcarbamate | XODLOLQRSQGSFE-LURJTMIESA-N | DS-13481 | MFCD04113636 | (4S)-4-BOC-AMINOOXOLAN-2-ONE | tert-Butyl (3S)-5-oxotetrahydro-3-furanylcarbamate |
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
S189469-1g
3

$20.90

$31.90
Save $11.00 (34.48%)
5g
S189469-5g
2

$57.90

$86.90
Save $29.00 (33.37%)
10g
S189469-10g
1

$104.90

$157.90
Save $53.00 (33.57%)
25g
S189469-25g
1

$250.90

$376.90
Save $126.00 (33.43%)
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Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
(3S)-5-oxotetrahydro-3-furanylcarbamic acid tert-butyl ester | tert-butyl(3s)-5-oxotetrahydro-3-furanylcarbamate | XODLOLQRSQGSFE-LURJTMIESA-N | DS-13481 | MFCD04113636 | (4S)-4-BOC-AMINOOXOLAN-2-ONE | tert-Butyl (3S)-5-oxotetrahydro-3-furanylcarbamate |
Specifications & Purity
≥98%
Storage
Room temperature
Shipped In
Normal
Purity
≥98%
Names and Identifiers
Pubchem Sid488196959
Canonical SmilesCC(C)(C)OC(=O)NC1CC(=O)OC1
IUPAC Nametert-butyl N-[(3S)-5-oxooxolan-3-yl]carbamate
InChIKeyXODLOLQRSQGSFE-LURJTMIESA-N
INCHI1S/C9H15NO4/c1-9(2,3)14-8(12)10-6-4-7(11)13-5-6/h6H,4-5H2,1-3H3,(H,10,12)/t6-/m0/s1
Isomeric SMILES CC(C)(C)OC(=O)N[C@H]1CC(=O)OC1
PubChem CID 10943528
Molecular Weight 201.22

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

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✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassLactones
SubclassGamma butyrolactones
Intermediate Tree Nodes Not available
Direct ParentGamma butyrolactones
Alternative Parents Oxolanes  Carbamate esters  Carboxylic acid esters  Oxacyclic compounds  Monocarboxylic acids and derivatives  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic heteromonocyclic compounds
Substituents Gamma butyrolactone - Carbamic acid ester - Oxolane - Carboxylic acid ester - Oxacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aliphatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as gamma butyrolactones. These are compounds containing a gamma butyrolactone moiety, which consists of an aliphatic five-member ring with four carbon atoms, one oxygen atom, and bears a ketone group on the carbon adjacent to the oxygen atom.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

9 results found

Lot NumberCertificate TypeDateItem
L2216484Certificate of AnalysisJun 09, 2026 S189469
L2216495Certificate of AnalysisJun 09, 2026 S189469
L2216571Certificate of AnalysisJun 09, 2026 S189469
L2216572Certificate of AnalysisJun 09, 2026 S189469
L2216596Certificate of AnalysisJun 09, 2026 S189469
L2216597Certificate of AnalysisJun 09, 2026 S189469
L2216599Certificate of AnalysisJun 09, 2026 S189469
L2216607Certificate of AnalysisJun 09, 2026 S189469
K1908118Certificate of AnalysisJun 08, 2023 S189469
Chemical and Physical Properties
Melt Point(°C)108-112℃
Molecular Weight201.220 g/mol
XLogP30.600
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass201.1 Da
Monoisotopic Mass201.1 Da
Topological Polar Surface Area64.599 Ų
Heavy Atom Count14
Formal Charge0
Complexity244.000
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
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