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CAS 855863-93-3 3-((tert-Butoxycarbonyl)aMino)cyclopentanecarboxylic acid molecular structure lightbox
CAS RN: 855863-93-3

3-((tert-Butoxycarbonyl)aMino)cyclopentanecarboxylic acid

Product Availability

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6 package records6 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260411 100g In stock Shanghai Inquiry
Batchno.20260519 10g In stock Shanghai, Tianjin, Chengdu Inquiry
Batchno.20260616 1g In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250609 250mg In stock Shanghai Inquiry
Batchno.20250701 25g In stock Shanghai, Shenzhen Inquiry
Batchno.20250217 5g In stock Shanghai, Tianjin Inquiry
  • Product code: SSC-194034
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 5g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 855863-93-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Shenzhen Inquiry

855863-93-3 / 3-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopentane-1-carboxylic acid

Standard CAS: 855863-93-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
855863-93-3
Multi CAS
Yes
Molecular Formula
C11H19NO4
Molecular Weight
229.270000
Exact Mass
229.131408
InChI
InChI=1S/C11H19NO4/c1-11(2,3)16-10(15)12-8-5-4-7(6-8)9(13)14/h7-8H,4-6H2,1-3H3,(H,12,15)(H,13,14)
InChIKey
RNJQBGXOSAQQDG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Fraction Csp3
0.82
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
2
Molar refractivity
58.13
TPSA
75.63

LogP / Solubility

WLOGP
1.76
MLOGP
1.56
XLogP3
1.4
Consensus LogP
1.57
Log S (ESOL)
-2.24
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.71
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.85
Class (SILICOS-IT)
Moderately 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)
-2.87

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

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