[email protected]
CAS 1291-47-0 1,1′-Dimethylferrocene molecular structure lightbox
CAS RN: 1291-47-0

1,1′-Dimethylferrocene

Product Availability

Choose a grade to view its available package options.

4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250605 100g Out of stock Inquiry
Batchno.20251222 1g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20260426 25g In stock Shanghai, Tianjin, Chengdu Inquiry
Batchno.20250821 5g In stock Shanghai, Tianjin Inquiry
  • Product code: SSC-036282
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: 5g
  • 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 1291-47-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Hong Kong Inquiry

1291-47-0 / 1,1′-Dimethylferrocene

Standard CAS: 1291-47-0 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1291-47-0
Multi CAS
No
Molecular Formula
C12H14Fe
Molecular Weight
214.080000
Exact Mass
214.044486
SMILES
CC1=CC=C[CH]1.CC1=CC=C[CH]1.[Fe]
InChI
InChI=1S/2C6H7.Fe/c2*1-6-4-2-3-5-6;/h2*2-5H,1H3;
InChIKey
GJFIEPAJMYPAGC-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Fraction Csp3
0.17
Molar refractivity
54.39
TPSA
0.0000

LogP / Solubility

WLOGP
3.41
MLOGP
3
XLogP3
3.41
Consensus LogP
3.27
Log S (ESOL)
-3.32
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.78
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.88
Class (SILICOS-IT)
Poorly 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)
-1.6

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 (10%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (10%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (10%): 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