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CAS 1174020-45-1 (3S,4S)-1-Boc-4-fluoro-3-piperidinol molecular structure lightbox
CAS RN: 1174020-45-1

(3S,4S)-1-Boc-4-fluoro-3-piperidinol

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250504 50mg / 250mg Out of stock 8-10 business days Inquiry
  • Product code: SSC-017257
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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: 1g
  • 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 1174020-45-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

1174020-45-1 / tert-butyl (3S,4S)-4-fluoro-3-hydroxypiperidine-1-carboxylate

TRANS-1-BOC-4-FLUORO-3-HYDROXYPIPERIDINE | trans-tert-butyl 4-fluoro-3-hydroxypiperidine-1-carboxylate | (3S,4S)-tert-butyl 4-fluoro-3-hydroxypiperidine-1-carboxylate

Standard CAS: 1174020-45-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1174020-45-1
Multi CAS
Yes
Molecular Formula
C10H18FNO3
Molecular Weight
219.250000
Exact Mass
219.127072
SMILES
CC(C)(C)OC(=O)N1CC[C@@H]([C@H](C1)O)F
InChI
InChI=1S/C10H18FNO3/c1-10(2,3)15-9(14)12-5-4-7(11)8(13)6-12/h7-8,13H,4-6H2,1-3H3/t7-,8-/m0/s1
InChIKey
FZAKOAFETOZBLC-YUMQZZPRSA-N
Synonyms
TRANS-1-BOC-4-FLUORO-3-HYDROXYPIPERIDINE trans-tert-butyl 4-fluoro-3-hydroxypiperidine-1-carboxylate (3S,4S)-tert-butyl 4-fluoro-3-hydroxypiperidine-1-carboxylate tert-butyl (3S,4S)-4-fluoro-3-hydroxypiperidine-1-carboxylate (3S,4S)-1-Boc-4-fluoro-3-piperidinol

Computed Properties

Structural Parameters

Heavy atom count
15
Fraction Csp3
0.9
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
53.33
TPSA
49.77

LogP / Solubility

WLOGP
1.33
MLOGP
1.17
XLogP3
1
Consensus LogP
1.17
Log S (ESOL)
-2.03
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.32
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.19
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)
-3.12

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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