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CAS 77450-03-4 1-N-BOC-(2R,4S)-4-HYDROXY-2-(HYDROXYMETHYL) PYRROLIDINE molecular structure lightbox
CAS RN: 77450-03-4

1-N-BOC-(2R,4S)-4-HYDROXY-2-(HYDROXYMETHYL) PYRROLIDINE

Product Availability

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5 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250301 100mg In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20251126 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
Batchno.20251215 1g In stock Shanghai, Shenzhen, Chengdu Inquiry
Batchno.20260501 250mg In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250225 5g In stock Shanghai, Shenzhen Inquiry
  • Product code: SSC-187008
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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 77450-03-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Beijing Inquiry

77450-03-4 / tert-butyl 4-hydroxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate

Standard CAS: 77450-03-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
77450-03-4
Multi CAS
Yes
Molecular Formula
C10H19NO4
Molecular Weight
217.260000
Exact Mass
217.131408
InChI
InChI=1S/C10H19NO4/c1-10(2,3)15-9(14)11-5-8(13)4-7(11)6-12/h7-8,12-13H,4-6H2,1-3H3/t7-,8+/m1/s1
InChIKey
UFJNFQNQLMGUTQ-SFYZADRCSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Fraction Csp3
0.9
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
2
Molar refractivity
54.44
TPSA
70

LogP / Solubility

WLOGP
0.35
MLOGP
0.31
Consensus LogP
0.22
Log S (ESOL)
-1.34
Class (ESOL)
Soluble
Log S (Ali)
-1.59
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.48
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)
-3.8

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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