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CAS 115532-50-8 Tetramethylrhodamine Methyl Ester Perchlorate molecular structure lightbox
CAS RN: 115532-50-8

Tetramethylrhodamine Methyl Ester Perchlorate

Product Availability

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5 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250924 100mg In stock Shanghai Inquiry
Batchno.20260430 10mg / 50mg / 250mg Confirm by inquiry Shanghai, Shandong, Guangdong Inquiry
Batchno.20250711 1g In stock Shanghai Inquiry
Batchno.20250517 250mg In stock Shanghai Inquiry
Batchno.20250415 50mg Out of stock Inquiry
  • Product code: SSC-015300
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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 115532-50-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >95% 0 Out of Stock Hong Kong Inquiry

115532-50-8 / [6-(dimethylamino)-9-(2-methoxycarbonylphenyl)xanthen-3-ylidene]-dimethylazanium perchlorate

Tetramethylrhodamine methyl ester perchlorate | RefChem:897364 | 634-218-8

Standard CAS: 115532-50-8 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
115532-50-8
Multi CAS
Yes
Molecular Formula
C25H25ClN2O7
Molecular Weight
500.900000
Exact Mass
500.135029
SMILES
CN(C)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](C)C)C=C3O2)C4=CC=CC=C4C(=O)OC.[O-]Cl(=O)(=O)=O
InChI
InChI=1S/C25H25N2O3.ClHO4/c1-26(2)16-10-12-20-22(14-16)30-23-15-17(27(3)4)11-13-21(23)24(20)18-8-6-7-9-19(18)25(28)29-5;2-1(3,4)5/h6-15H,1-5H3;(H,2,3,4,5)/q+1;/p-1
InChIKey
PFYWPQMAWCYNGW-UHFFFAOYSA-M
Synonyms
Tetramethylrhodamine methyl ester perchlorate RefChem:897364 634-218-8 TMRM Perchlorate 3,6-bis(dimethylamino)-9-(2-(methoxycarbonyl)phenyl)xanthylium perchlorate

Computed Properties

Structural Parameters

Heavy atom count
35
Aromatic heavy atom count
20
Fraction Csp3
0.2
Rotatable bonds
3
H-bond acceptors
8
Molar refractivity
121.06
TPSA
137.93

LogP / Solubility

WLOGP
-0.67
MLOGP
-0.55
XLogP3
-0.67
Consensus LogP
-0.63
Log S (ESOL)
-2.75
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.19
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-2.72
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-6.25

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (97.4%): 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

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