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CAS 111061-56-4 Fmoc-O-trityl-L-serine molecular structure lightbox
CAS RN: 111061-56-4

Fmoc-O-trityl-L-serine

Product Availability

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6 package records6 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250901 100g In stock Inquiry
Batchno.20251221 25g In stock Inquiry
Batchno.20251213 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250708 100g In stock Shanghai, Shandong Inquiry
Batchno.20260628 25g In stock Shanghai, Shandong, Guangdong Inquiry
Batchno.20260208 500g In stock Shanghai Inquiry
  • Product code: SSC-011942
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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: 5g, 10g, 25g, 100g, 1g, 500g
  • Available purity: >98%
  • Inventory rows with stock: 5
  • 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 111061-56-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g >98% 5 In Stock Shenzhen Inquiry
10g >98% 5 In Stock Beijing Inquiry
25g >98% 5 In Stock Shenzhen Inquiry
100g >98% 5 In Stock Shenzhen Inquiry
1g >98% 3 In Stock Shanghai Inquiry
500g >98% 0 Out of Stock Hong Kong Inquiry

111061-56-4 / (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-trityloxypropanoic acid

Fmoc-O-trityl-L-serine | C37H31NO5 | 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-trityloxy-propanoic Acid

Standard CAS: 111061-56-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
111061-56-4
Multi CAS
Yes
Molecular Formula
C37H31NO5
Molecular Weight
569.600000
Exact Mass
569.220223
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)OC[C@@H](C(=O)O)NC(=O)OCC4C5=CC=CC=C5C6=CC=CC=C46
InChI
InChI=1S/C37H31NO5/c39-35(40)34(38-36(41)42-24-33-31-22-12-10-20-29(31)30-21-11-13-23-32(30)33)25-43-37(26-14-4-1-5-15-26,27-16-6-2-7-17-27)28-18-8-3-9-19-28/h1-23,33-34H,24-25H2,(H,38,41)(H,39,40)/t34-/m0/s1
InChIKey
UCARTONYOJORBQ-UMSFTDKQSA-N
Synonyms
Fmoc-O-trityl-L-serine C37H31NO5 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-trityloxy-propanoic Acid N-|A-Fmoc-O-trityl-D-serine PD196257

Computed Properties

Structural Parameters

Heavy atom count
43
Aromatic heavy atom count
30
Fraction Csp3
0.14
Rotatable bonds
10
H-bond acceptors
4
H-bond donors
2
Molar refractivity
164.79
TPSA
84.86

LogP / Solubility

WLOGP
6.99
MLOGP
6.19
XLogP3
7.2
Consensus LogP
6.79
Log S (ESOL)
-7.63
Class (ESOL)
Insoluble
Log S (Ali)
-9.28
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-10.36
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.23

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
6

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