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CAS 101385-93-7 1-tert-Butoxycarbonyl-3-pyrrolidone molecular structure lightbox
CAS RN: 101385-93-7

1-tert-Butoxycarbonyl-3-pyrrolidone

Product Availability

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7 package records6 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260418 100g In stock Inquiry
Batchno.20260424 10g In stock Inquiry
Batchno.20260309 1g In stock Inquiry
Batchno.20260328 25g Out of stock Inquiry
Batchno.20260409 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260514 1g / 5g / 25g / 100g / 500g Confirm by inquiry Shanghai, Shandong 5-7 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260122 5g / 25g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-002215
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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: 1g, 5g, 10g, 25g, 100g, 500g, 1000g
  • Available purity: >97%
  • Inventory rows with stock: 6
  • 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 101385-93-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >97% 5 In Stock Shanghai Inquiry
5g >97% 5 In Stock Shenzhen Inquiry
10g >97% 5 In Stock Shanghai Inquiry
25g >97% 5 In Stock Hong Kong Inquiry
100g >97% 5 In Stock Shanghai Inquiry
500g >97% 1 In Stock Beijing Inquiry
1000g >97% 0 Out of Stock Hong Kong Inquiry

101385-93-7 / tert-butyl 3-oxopyrrolidine-1-carboxylate

tert-butyl 3-oxopyrrolidine-1-carboxylate | 3-Oxopyrrolidine-1-carboxylic Acid tert-Butyl Ester | RefChem:893465

Standard CAS: 101385-93-7 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
101385-93-7
Multi CAS
Yes
Molecular Formula
C9H15NO3
Molecular Weight
185.220000
Exact Mass
185.105193
SMILES
CC(C)(C)OC(=O)N1CCC(=O)C1
InChI
InChI=1S/C9H15NO3/c1-9(2,3)13-8(12)10-5-4-7(11)6-10/h4-6H2,1-3H3
InChIKey
JSOMVCDXPUXKIC-UHFFFAOYSA-N
Synonyms
tert-butyl 3-oxopyrrolidine-1-carboxylate 3-Oxopyrrolidine-1-carboxylic Acid tert-Butyl Ester RefChem:893465 600-204-5 N-Boc-3-pyrrolidinone

Computed Properties

Structural Parameters

Heavy atom count
13
Fraction Csp3
0.78
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
47.43
TPSA
46.61

LogP / Solubility

WLOGP
1.2
MLOGP
1.05
XLogP3
0.7
Consensus LogP
0.98
Log S (ESOL)
-1.74
Class (ESOL)
Soluble
Log S (Ali)
-1.94
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.86
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

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Corrosive Irritant
Signal
Danger
GHS Hazard Statements
H302 (81.1%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H318 (75.5%): Causes serious eye damage [Danger Serious eye damage/eye irritation] H319 (24.5%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (94.3%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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