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2-Amino-4-(2,2-dichlorovinyl)-6-methoxypyrimidine

HCID 20153503
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Basic information

Standard SMILES
COc1cc(C=C(Cl)Cl)nc(N)n1
InChIKey
XQACDZSMBXRZDI-UHFFFAOYSA-N
Molecular formula
C7H7Cl2N3O
Average molar mass
220.05 g/mol

Names & identifiers

Preferred name
2-Amino-4-(2,2-dichlorovinyl)-6-methoxypyrimidine
IUPAC
4-(2,2-dichloroethenyl)-6-methoxypyrimidin-2-amine

Names & synonyms

SCHEMBL10617519XQACDZSMBXRZDI-UHFFFAOYSA-N2-amino-4-(2,2-dichlorovinyl)-6-methoxypyrimidine

Database identifiers

PubChem CID
20153503

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
61 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
13
Formal charge
0
Complexity
196

Related reactions

2 records
New reaction record
HRID 3909 reaction equation
HRID 3909As productuspto-grants-1988_02
HRID 2310103 reaction equation
HRID 2310103As productTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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