[email protected]
CAS 1074-40-4 2-Methoxy-4,6-dichloropyrimidine molecular structure lightbox
CAS RN: 1074-40-4

2-Methoxy-4,6-dichloropyrimidine

  • Product code: SSC-008990
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, 1g, 5g, 10g, 25g, 100g
  • Available purity: ≥98%
  • Inventory rows with stock: 1
  • 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 1074-40-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥98% 1 In Stock Hong Kong Inquiry
1g ≥98% 0 Out of Stock Hong Kong Inquiry
5g ≥98% 0 Out of Stock Shenzhen Inquiry
10g ≥98% 0 Out of Stock Shanghai Inquiry
25g ≥98% 0 Out of Stock Shanghai Inquiry
100g ≥98% 0 Out of Stock Beijing Inquiry

1074-40-4 / 4,6-dichloro-2-methoxypyrimidine

4,6-dichloro-2-methoxypyrimidine | DTXSID30476537 | RefChem:285783

Standard CAS: 1074-40-4 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1074-40-4
Multi CAS
Yes
Molecular Formula
C5H4Cl2N2O
Molecular Weight
179.000000
Exact Mass
177.970068
SMILES
COC1=NC(=CC(=N1)Cl)Cl
InChI
InChI=1S/C5H4Cl2N2O/c1-10-5-8-3(6)2-4(7)9-5/h2H,1H3
InChIKey
WDELVDLDINRUQF-UHFFFAOYSA-N
Synonyms
4,6-dichloro-2-methoxypyrimidine DTXSID30476537 RefChem:285783 DTXCID30427347 2-Methoxy-4,6-dichloropyrimidine

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.2
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
38.6
TPSA
35.01

LogP / Solubility

WLOGP
1.79
MLOGP
1.57
XLogP3
2.4
Consensus LogP
1.92
Log S (ESOL)
-2.46
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.32
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.43
Class (SILICOS-IT)
Moderately 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)
-2.54

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

Customers Also Viewed

Get In Touch

Contact Us