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CAS 71803-59-3 3-HydroxyMethylpyrrole molecular structure lightbox
CAS RN: 71803-59-3

3-HydroxyMethylpyrrole

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260116 1g / 5g Out of stock 8-10 business days Inquiry
  • Product code: SSC-181371
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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 71803-59-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

71803-59-3 / 1H-pyrrol-2-ylmethanol

Standard CAS: 71803-59-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
71803-59-3
Multi CAS
Yes
Molecular Formula
C5H7NO
Molecular Weight
97.120000
Exact Mass
97.052764
InChI
InChI=1S/C5H7NO/c7-4-5-2-1-3-6-5/h1-3,6-7H,4H2
InChIKey
KORIJXKQGMTQTO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
7
Aromatic heavy atom count
5
Fraction Csp3
0.2
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
2
Molar refractivity
26.72
TPSA
36.02

LogP / Solubility

WLOGP
0.51
MLOGP
0.43
XLogP3
-0.1
Consensus LogP
0.28
Log S (ESOL)
-1.22
Class (ESOL)
Soluble
Log S (Ali)
-0.72
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.83
Class (SILICOS-IT)
Very 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)
-2.95

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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