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CAS 114248-23-6 2′,2′-DIFLUORO-2′-DEOXYURIDINE molecular structure lightbox
CAS RN: 114248-23-6

2′,2′-DIFLUORO-2′-DEOXYURIDINE

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260409 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-014121
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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: ＞97%
  • 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 114248-23-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Beijing Inquiry

114248-23-6 / 1-[(2R,4R,5R)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione

2'-Deoxy-2',2'-difluorouridine | 2',2'-Difluorodeoxyuridine | Uridine, 2'-deoxy-2',2'-difluoro-

Standard CAS: 114248-23-6 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
114248-23-6
Multi CAS
Yes
Molecular Formula
C9H10F2N2O5
Molecular Weight
264.180000
Exact Mass
264.055778
SMILES
C1=CN(C(=O)NC1=O)[C@H]2C([C@@H]([C@H](O2)CO)O)(F)F
InChI
InChI=1S/C9H10F2N2O5/c10-9(11)6(16)4(3-14)18-7(9)13-2-1-5(15)12-8(13)17/h1-2,4,6-7,14,16H,3H2,(H,12,15,17)/t4-,6-,7-/m1/s1
InChIKey
FIRDBEQIJQERSE-QPPQHZFASA-N
Synonyms
2'-Deoxy-2',2'-difluorouridine 2',2'-Difluorodeoxyuridine Uridine, 2'-deoxy-2',2'-difluoro- MFCD00871912 Gemcitabine EP Impurity C

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
6
Fraction Csp3
0.56
Rotatable bonds
2
H-bond acceptors
6
H-bond donors
3
Molar refractivity
53.27
TPSA
104.55

LogP / Solubility

WLOGP
-1.58
MLOGP
-1.38
XLogP3
-1.3
Consensus LogP
-1.42
Log S (ESOL)
-0.6
Class (ESOL)
Very soluble
Log S (Ali)
-0.59
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.31
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.45

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3

Safety & Transport

Pictogram(s)
Irritant Health Hazard Environmental Hazard
Signal
Danger
GHS Hazard Statements
H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H340 (50%): May cause genetic defects [Danger Germ cell mutagenicity]
Precautionary Statement Codes
P203, P260, P264, P264+P265, P270, P273, P280, P301+P317, P302+P352, P305+P351+P338, P317, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P405, and P501

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