4,6-Dichloro-2-(methoxymethyl)pyrimidine

HCID 53438121

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Basic information

CAS: 1903-92-0
Standard SMILES: COCc1nc(Cl)cc(Cl)n1
InChIKey: JEGIGVNQAHMOII-UHFFFAOYSA-N
Molecular formula: C6H6Cl2N2O
Average molar mass: 193.03 g/mol
Monoisotopic mass: 191.98571817

Names & identifiers

Preferred name: 4,6-Dichloro-2-(methoxymethyl)pyrimidine
IUPAC: 4,6-dichloro-2-(methoxymethyl)pyrimidine
English name: 4,6-DICHLORO-2-METHOXYMETHYLPYRIMIDINE
Molecular formula: C6H6Cl2N2O
Molecular weight: 193.03

Names & synonyms

4,6-Dichloro-2-(methoxymethyl)pyrimidine1903-92-0DTXSID30701194RefChem:96619DTXCID70651942852-877-14,6-Dichloro-2-methoxymethylpyrimidineMFCD11043814Pyrimidine, 4,6-dichloro-2-(methoxymethyl)-SCHEMBL3878733JEGIGVNQAHMOII-UHFFFAOYSA-NBAA90392

Show more names

4,6-Dichloro-2-Methoxymethylpyrimidine(WX636054)4,6-DICHLORO-2-METHOXYMETHYLPYRIMIDINE ISO 9001：2015 REACH

AKOS012922338SB561244,6-dichloro-2-methoxymethyl-pyrimidine46-Dichloro-2-(methoxymethyl)pyrimidineAS-63717SY123988DB-153078CS-0039101

Database identifiers

CAS: 1903-92-0
PubChem CID: 53438121
DTXSID: DTXSID30701194
EC Number: 852-877-1

Properties

Computed structural properties

XLogP: 1.8
Topological polar surface area: 35 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 2
Heavy atoms: 11
Formal charge: 0
Complexity: 115

Physicochemical properties

Melting point: 71 ℃ · 71℃
Boiling point: 240 ℃ · 240℃
Density: 1.389 · 1.389
Flash point: 99 ℃ · 99℃
storage temp.: -20 °C, · -20°C, sealed storage, away from moisture
pka: -4.9 · -4.90±0.30(Predicted)
Appearance: White to off-white Solid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

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 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.