HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.9
  1. Home
  2. /Compound

4,6-Dimethoxy-2-methylpyrimidine

HCID 11040904
New noteNew reactionRequest quotesPrint preview

Completing data — refresh the page later to see the latest

Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
13566-48-8
Standard SMILES
COc1cc(OC)nc(C)n1
InChIKey
FWQJAXMTUACMLK-UHFFFAOYSA-N
Molecular formula
C7H10N2O2
Average molar mass
154.17 g/mol
Monoisotopic mass
154.07422756

Names & identifiers

Preferred name
4,6-Dimethoxy-2-methylpyrimidine
IUPAC
4,6-dimethoxy-2-methylpyrimidine
English name
4,6-Dimethoxy-2-methylpyrimidine
Molecular formula
C7H10N2O2
Molecular weight
154.17

Names & synonyms

13566-48-84,6-Dimethoxy-2-methylpyrimidineDTXSID00452904RefChem:285879DTXCID904037232-methyl-4,6-dimethoxypyrimidineMFCD06657567Pyrimidine, 4,6-dimethoxy-2-methyl-4,6-dimethoxy-2-meth4,6-dimethoxy-2-methyl-pyrimidine2-methyl-4,6-dimethoxypyrimidine ,99+%SCHEMBL423183
Show more names
4,6-Dimethoxy-2-methylpyrimidine ISO 9001:2015 REACH
SCHEMBL486278SCHEMBL8835612FWQJAXMTUACMLK-UHFFFAOYSA-NAKOS006292335AC-9319SB57761AS-11878SY017822

Database identifiers

CAS
13566-48-8
PubChem CID
11040904
DTXSID
DTXSID00452904

Properties

Computed structural propertiesFilling in

XLogP
1.2
Topological polar surface area
44.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
11
Formal charge
0
Complexity
109

Physicochemical properties

Melting point
52 · 52-53 °C
Boiling point
235.5 · 235.5±20.0 °C(Predicted)
Density
1.099 · 1.099±0.06 g/cm3(Predicted)
storage temp.
Sealed in dry,Room Temperature
pka
1.84 · 1.84±0.30(Predicted)
CAS DataBase Reference
13566 · 13566-48-8(CAS DataBase Reference)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P305+P351+P338
HS Code
2933599590 · 2933599590

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

hs_code
2933599590
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Upstream & downstream products

Downstream products

4,6-Dimethoxypyrimidine-2-carboxylic acid4,6-Dimethoxypyrimidine-2-carboxaldehyde

Suppliers

Loading…

Open inquiries

Loading…

Related reactions

2 records
New reaction record
HRID 156508 reaction equation
HRID 156508As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 1034407 reaction equation
HRID 1034407As reactantuspto-grants-1994_05

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes