[email protected]
CAS 16554-45-3 2-METHOXY-6-NITRO-PHENYLAMINE molecular structure lightbox
CAS RN: 16554-45-3

2-METHOXY-6-NITRO-PHENYLAMINE

Product Availability

Choose a grade to view its available package options.

8 package records7 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251105 100g In stock Inquiry
Batchno.20250813 10g In stock Inquiry
Batchno.20250406 1g In stock Inquiry
Batchno.20250911 250mg In stock Inquiry
Batchno.20250825 25g Out of stock Inquiry
Batchno.20250505 500g In stock Inquiry
Batchno.20250428 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260326 10g / 25g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-072300
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: 1g, 10g, 5g
  • Available purity: >97%
  • Inventory rows with stock: 2
  • 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 16554-45-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >97% 3 In Stock Hong Kong Inquiry
10g >97% 1 In Stock Shanghai Inquiry
5g >97% 0 Out of Stock Beijing Inquiry

16554-45-3 / 2-methoxy-6-nitroaniline

Standard CAS: 16554-45-3 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
16554-45-3
Multi CAS
No
Molecular Formula
C7H8N2O3
Molecular Weight
168.150000
Exact Mass
168.053492
SMILES
COC1=CC=CC(=C1N)[N+](=O)[O-]
InChI
InChI=1S/C7H8N2O3/c1-12-6-4-2-3-5(7(6)8)9(10)11/h2-4H,8H2,1H3
InChIKey
NDKWDGCTUOOAPF-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.14
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
44.06
TPSA
78.39

LogP / Solubility

WLOGP
1.19
MLOGP
1.04
XLogP3
0.7
Consensus LogP
0.98
Log S (ESOL)
-1.87
Class (ESOL)
Soluble
Log S (Ali)
-1.79
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.98
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)
-2.9

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)
Acute Toxic Irritant
Signal
Danger
GHS Hazard Statements
H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral] H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (50%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P316, 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