[email protected]
CAS 1192-58-1 1-Methyl-2-pyrrolecarboxaldehyde molecular structure lightbox
CAS RN: 1192-58-1

1-Methyl-2-pyrrolecarboxaldehyde

Product Availability

Choose a grade to view its available package options.

4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260509 100g Out of stock 8-10 business days Inquiry
Batchno.20260206 1g In stock Shanghai Inquiry
Batchno.20250512 25g In stock Shanghai, Shandong Inquiry
Batchno.20250227 5g In stock Shanghai, Shandong, Hebei Inquiry
  • Product code: SSC-019686
GET A QUOTE
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: 10g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

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 1192-58-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ＞97% 0 Out of Stock Beijing Inquiry

1192-58-1 / 1-methylpyrrole-2-carbaldehyde

1-Methyl-1H-pyrrole-2-carbaldehyde | RefChem:76214 | InChI=1/C8H10ClNO/c1-2-3-7(11)8-6(9)4-5-10-8/h4-5,10H,2-3H2,1H

Standard CAS: 1192-58-1 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
1192-58-1
Multi CAS
No
Molecular Formula
C6H7NO
Molecular Weight
109.130000
Exact Mass
109.052764
SMILES
CN1C=CC=C1C=O
InChI
InChI=1S/C6H7NO/c1-7-4-2-3-6(7)5-8/h2-5H,1H3
InChIKey
OUKQTRFCDKSEPL-UHFFFAOYSA-N
Synonyms
1-Methyl-1H-pyrrole-2-carbaldehyde RefChem:76214 InChI=1/C8H10ClNO/c1-2-3-7(11)8-6(9)4-5-10-8/h4-5,10H,2-3H2,1H 1-Methylpyrrole-2-carboxaldehyde N-Methylpyrrole-2-carboxaldehyde

Physical Properties

Boiling Point
87.00 to 90.00 °C. @ 22.00 mm Hg
Density
1.012-1.018
Physical Description
Clear orange to dark red liquid; roasted nutty aroma
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
8
Aromatic heavy atom count
5
Fraction Csp3
0.17
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
30.8
TPSA
22

LogP / Solubility

WLOGP
0.84
MLOGP
0.73
XLogP3
0.5
Consensus LogP
0.69
Log S (ESOL)
-1.44
Class (ESOL)
Soluble
Log S (Ali)
-1.06
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.18
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)
-2.79

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
H315 (32.8%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (32.8%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (32.1%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

Customers Also Viewed

Get In Touch

Contact Us