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CAS 188527-21-1 1-N-CBZ-PYRROLIDINE-3-CARBOXYLIC ACID molecular structure lightbox
CAS RN: 188527-21-1

1-N-CBZ-PYRROLIDINE-3-CARBOXYLIC ACID

Product Availability

Choose a grade to view its available package options.

9 package records9 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250512 1g In stock Inquiry
Batchno.20251025 25g In stock Inquiry
Batchno.20260308 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250921 100g In stock Shanghai Inquiry
Batchno.20250602 10g In stock Shanghai Inquiry
Batchno.20251012 1g In stock Shanghai, Tianjin Inquiry
Batchno.20251024 250mg In stock Shanghai, Tianjin Inquiry
Batchno.20260110 25g In stock Shanghai Inquiry
Batchno.20250720 5g In stock Shanghai Inquiry
  • Product code: SSC-087747
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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
  • Available purity: >97%
  • Inventory rows with stock: 2
  • 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 188527-21-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g -- 1 In Stock Hong Kong Inquiry
1g >97% 1 In Stock Shenzhen Inquiry
5g -- 0 Out of Stock Hong Kong Inquiry
5g >97% 0 Out of Stock Shanghai Inquiry
10g -- 0 Out of Stock Beijing Inquiry
10g >97% 0 Out of Stock Hong Kong Inquiry
25g -- 0 Out of Stock Hong Kong Inquiry
25g >97% 0 Out of Stock Shanghai Inquiry

188527-21-1 / 1-phenylmethoxycarbonylpyrrolidine-3-carboxylic acid

Standard CAS: 188527-21-1 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
188527-21-1
Multi CAS
No
Molecular Formula
C13H15NO4
Molecular Weight
249.260000
Exact Mass
249.100108
SMILES
C1CN(CC1C(=O)O)C(=O)OCC2=CC=CC=C2
InChI
InChI=1S/C13H15NO4/c15-12(16)11-6-7-14(8-11)13(17)18-9-10-4-2-1-3-5-10/h1-5,11H,6-9H2,(H,15,16)
InChIKey
JSASVUTVTRNJHA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
6
Fraction Csp3
0.38
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
1
Molar refractivity
63.94
TPSA
66.84

LogP / Solubility

WLOGP
1.73
MLOGP
1.53
XLogP3
1.3
Consensus LogP
1.52
Log S (ESOL)
-2.52
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.85
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.08
Class (SILICOS-IT)
Poorly 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)
-3.01

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

Safety & Transport

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

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