[email protected]
CAS 102846-11-7 (1-Benzyl-1H-pyrazol-3-yl)-methanol molecular structure lightbox
CAS RN: 102846-11-7

(1-Benzyl-1H-pyrazol-3-yl)-methanol

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250930 100mg / 250mg / 500mg Out of stock 8-10 business days Inquiry
  • Product code: SSC-004193
GET A QUOTE
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: 0.1g, 0.25g, 5g, 1g
  • Available purity: ≥97%
  • Inventory rows with stock: 3
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

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 102846-11-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥97% 1 In Stock Hong Kong Inquiry
0.25g ≥97% 1 In Stock Shanghai Inquiry
5g ≥97% 1 In Stock Beijing Inquiry
1g ≥97% 0 Out of Stock Shanghai Inquiry

102846-11-7 / (1-benzylpyrazol-3-yl)methanol

(1-benzylpyrazol-3-yl)methanol | 1-Benzyl-3-(hydroxymethyl)pyrazole | (1-benzyl-1H-pyrazol-3-yl)methanol

Standard CAS: 102846-11-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
102846-11-7
Multi CAS
No
Molecular Formula
C11H12N2O
Molecular Weight
188.230000
Exact Mass
188.094963
SMILES
C1=CC=C(C=C1)CN2C=CC(=N2)CO
InChI
InChI=1S/C11H12N2O/c14-9-11-6-7-13(12-11)8-10-4-2-1-3-5-10/h1-7,14H,8-9H2
InChIKey
QVEQOOSUPOKDAZ-UHFFFAOYSA-N
Synonyms
(1-benzylpyrazol-3-yl)methanol 1-Benzyl-3-(hydroxymethyl)pyrazole (1-benzyl-1H-pyrazol-3-yl)methanol 1H-Pyrazole-3-methanol, 1-(phenylmethyl)- MFCD28097962

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
11
Fraction Csp3
0.18
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
1
Molar refractivity
53.69
TPSA
38.05

LogP / Solubility

WLOGP
1.42
MLOGP
1.25
XLogP3
1
Consensus LogP
1.22
Log S (ESOL)
-2.29
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.13
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.43
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)
-2.86

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us