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CAS 113775-22-7 BOC-4-HYDROXY-L-PYRROLIDINE LACTONE molecular structure lightbox
CAS RN: 113775-22-7

BOC-4-HYDROXY-L-PYRROLIDINE LACTONE

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251121 1g In stock Shanghai, Wuhan Inquiry
Batchno.20250223 250mg In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20260629 250mg / 1g / 5g Confirm by inquiry Shanghai 5-7 business days Inquiry
Batchno.20250716 5g In stock Tianjin, Wuhan Inquiry
  • Product code: SSC-013766
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.25g, 1g, 5g
  • Available purity: >95%
  • Inventory rows with stock: 4
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 113775-22-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g -- 1 In Stock Shanghai Inquiry
0.25g >95% 1 In Stock Shenzhen Inquiry
1g -- 1 In Stock Shenzhen Inquiry
1g >95% 1 In Stock Beijing Inquiry
5g -- 0 Out of Stock Shenzhen Inquiry
5g >95% 0 Out of Stock Hong Kong Inquiry

113775-22-7 / tert-butyl (1S,4S)-3-oxo-2-oxa-5-azabicyclo[2.2.1]heptane-5-carboxylate

tert-butyl (1S,4S)-3-oxo-2-oxa-5-azabicyclo[2.2.1]heptane-5-carboxylate | Boc-4-Hydroxy-L-Pyrrolidine Lactone | (1S,4S)-tert-Butyl 3-oxo-2-oxa-5-azabicyclo[2.2.1]heptane-5-carboxylate

Standard CAS: 113775-22-7 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
113775-22-7
Multi CAS
Yes
Molecular Formula
C10H15NO4
Molecular Weight
213.230000
Exact Mass
213.100108
SMILES
CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1C(=O)O2
InChI
InChI=1S/C10H15NO4/c1-10(2,3)15-9(13)11-5-6-4-7(11)8(12)14-6/h6-7H,4-5H2,1-3H3/t6-,7-/m0/s1
InChIKey
LRUFZHMJIBJMPC-BQBZGAKWSA-N
Synonyms
tert-butyl (1S,4S)-3-oxo-2-oxa-5-azabicyclo[2.2.1]heptane-5-carboxylate Boc-4-Hydroxy-L-Pyrrolidine Lactone (1S,4S)-tert-Butyl 3-oxo-2-oxa-5-azabicyclo[2.2.1]heptane-5-carboxylate MFCD06797016 (1S,4S)-tert-Butyl-3-oxo-2-oxa-5-azabicyclo[2.2.1]heptane-5-carboxylate

Computed Properties

Structural Parameters

Heavy atom count
15
Fraction Csp3
0.8
Rotatable bonds
2
H-bond acceptors
4
Molar refractivity
51.23
TPSA
55.84

LogP / Solubility

WLOGP
0.92
MLOGP
0.81
XLogP3
1
Consensus LogP
0.91
Log S (ESOL)
-1.74
Class (ESOL)
Soluble
Log S (Ali)
-1.97
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.81
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.37

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4.5

Safety & Transport

Pictogram(s)
Flammable
Signal
Warning
GHS Hazard Statements
H228 (100%): Flammable solid [Danger Flammable solids]
Precautionary Statement Codes
P210, P240, P241, P280, and P370+P378

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