2,4-Dichloro-5-methoxypyrimidine

C5H4Cl2N2OCAS 19646-07-2179.00 g/mol

Open in Covalent MOL file
ONNClCl
Aryl halideEther

Properties

Molecular formula
C5H4Cl2N2O
Molar mass
179.00 g/mol
Exact mass
177.9701 Da
logP
1.79Crippen estimate
Polar surface area
35.0 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
1

Hazards

Danger
Corrosive (GHS05)Irritant (GHS07)

Aggregated from 42 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
19646-07-2
SMILES
COC1=CN=C(N=C1Cl)Cl
InChIKey
ZTHHRSBDBPCCMZ-UHFFFAOYSA-N
InChI
InChI=1S/C5H4Cl2N2O/c1-10-3-2-8-5(7)9-4(3)6/h2H,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 2,4-Dichloro-5-methoxypyrimidine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4-Chloro-5-methoxypyrimidine695-85-255 % similar 2-Chloro-6,7-dimethoxyquinazoline94644-47-053 % similar 2,4-Dichloro-5-methylpyrimidine1780-31-050 % similar 2,4-Dichloro-5-aminopyrimidine5177-27-550 % similar 2,4-Dichloro-6,7-dimethoxyquinazoline27631-29-449 % similar 2-Chloro-5-methoxypyrimidine22536-65-848 % similar 2,4,5-Trichloropyrimidine5750-76-548 % similar 2,4-Dichloro-8-methoxyquinazoline61948-60-547 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Methoxy-4,6-dichloropyrimidine1074-40-4 4,6-Dichloro-5-methoxypyrimidine5018-38-2 3,6-Dichloro-4-methoxypyridazine70952-62-4 4,5-Dichloro-2-methyl-3(2H)-pyridazinone933-76-6

Elsewhere

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