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6-oxa-3-azabicyclo[3.1.0]hexane-3-carboxylic acid tert-butyl ester - 97%, high purity , CAS No.114214-49-2

COA

Grade & Purity:

≥97%

Cas Number: 114214-49-2
Molecular Weight: 185.223
MDL number: MFCD08691407
PubChem CID: 10103880
PubChem SID: 488196534

In stock

Item Number

O172132

Grouped product items
SKU	Size	Availability	Price
O172132-1g	1g	6	$40.90
O172132-5g	5g	5	$149.90
O172132-25g	25g	5	$671.90
O172132-100g	100g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,416.90

View related series

Halogen free heterocyclic block (1207) Pyrrolidines (140)

Basic Description

Synonyms	SY010056 \| AKOS006228235 \| EINECS 205-418-9 \| 1-(tert-Butoxycarbonyl)-3,4-epoxypyrrolidine \| EN300-27365 \| GS-3878 \| 1-tert-butoxycarbonyl-3,4-epoxypyrrolidine \| A2325 \| 1-t-butoxycarbonyl-3,4-epoxypyrrolidine \| BB 0253897 \| 6-Oxa-3-aza-bicyclo[3.1.0]hexa
Specifications & Purity	≥97%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Oxazinanes
    - Subclass Morpholines
      - Level5 Morpholine carboxylic acids and derivatives
        Level6 Morpholine carboxylic acids

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Oxazinanes
Subclass	Morpholines
Intermediate Tree Nodes	Morpholine carboxylic acids and derivatives
Direct Parent	Morpholine carboxylic acids
Alternative Parents	Pyrrolidine carboxylic acids Carbamate esters Oxacyclic compounds Epoxides Dialkyl ethers Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aliphatic heteropolycyclic compounds
Substituents	Morpholine-4-carboxylic acid - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine - Carbamic acid ester - Dialkyl ether - Oxirane - Ether - Oxacycle - Azacycle - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Aliphatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as morpholine carboxylic acids. These are heterocyclic compounds containing a morpholine ring substituted by one or more carboxylic acid groups.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	488196534
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488196534
IUPAC Name	tert-butyl 6-oxa-3-azabicyclo[3.1.0]hexane-3-carboxylate
INCHI	InChI=1S/C9H15NO3/c1-9(2,3)13-8(11)10-4-6-7(5-10)12-6/h6-7H,4-5H2,1-3H3
InChIKey	NXZIGGBPLGAPTI-UHFFFAOYSA-N
Smiles	CC(C)(C)OC(=O)N1CC2C(C1)O2
Isomeric SMILES	CC(C)(C)OC(=O)N1CC2C(C1)O2
Molecular Weight	185.223
Reaxy-Rn	6138655
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6138655&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

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7 results found

Lot Number	Certificate Type	Date	Item
K1908121	Certificate of Analysis	Jun 10, 2025	O172132
E23081272	Certificate of Analysis	Jan 30, 2023	O172132
E23081278	Certificate of Analysis	Jan 30, 2023	O172132
E23081302	Certificate of Analysis	Jan 30, 2023	O172132
E23081290	Certificate of Analysis	Jan 30, 2023	O172132
E23081274	Certificate of Analysis	Jan 30, 2023	O172132
E23081279	Certificate of Analysis	Jan 30, 2023	O172132

Chemical and Physical Properties

Refractive Index	1.46
Flash Point(°C)	107 °C
Molecular Weight	185.220 g/mol
XLogP3	0.600
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	185.105 Da
Monoisotopic Mass	185.105 Da
Topological Polar Surface Area	42.100 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	224.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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