[email protected]
CAS 175204-81-6 4-CHLORO-1-METHYL-1H-PYRAZOLE-3-CARBALDEHYDE molecular structure lightbox
CAS RN: 175204-81-6

4-CHLORO-1-METHYL-1H-PYRAZOLE-3-CARBALDEHYDE

Product Availability

Choose a grade to view its available package options.

4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250902 1g In stock Inquiry
Batchno.20251102 250mg In stock Inquiry
Batchno.20251009 50mg In stock Inquiry
Batchno.20260322 5g In stock Inquiry
  • Product code: SSC-076850
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: 0.25g, 5g, 10g, 0.1g, 1g, 25g
  • Available purity: ≥95%
  • Inventory rows with stock: 5
  • 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 175204-81-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 3 In Stock Beijing Inquiry
5g ≥95% 3 In Stock Shanghai Inquiry
10g ≥95% 2 In Stock Shanghai Inquiry
0.1g ≥95% 1 In Stock Hong Kong Inquiry
1g ≥95% 1 In Stock Beijing Inquiry
25g ≥95% 0 Out of Stock Shanghai Inquiry

175204-81-6 / 4-chloro-1-methylpyrazole-3-carbaldehyde

Standard CAS: 175204-81-6 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
175204-81-6
Multi CAS
No
Molecular Formula
C5H5ClN2O
Molecular Weight
144.560000
Exact Mass
144.009041
SMILES
CN1C=C(C(=N1)C=O)Cl
InChI
InChI=1S/C5H5ClN2O/c1-8-2-4(6)5(3-9)7-8/h2-3H,1H3
InChIKey
MLGDASSMRFJUMZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Aromatic heavy atom count
5
Fraction Csp3
0.2
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
33.61
TPSA
34.89

LogP / Solubility

WLOGP
0.89
MLOGP
0.77
XLogP3
0.7
Consensus LogP
0.79
Log S (ESOL)
-1.64
Class (ESOL)
Soluble
Log S (Ali)
-1.39
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.46
Class (SILICOS-IT)
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)
-2.97

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (33.3%): 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] H332 (33.3%): Harmful if inhaled [Warning Acute toxicity, inhalation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

Customers Also Viewed

Get In Touch

Contact Us