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2,4-Dichloro-5,6-diphenylpyrimidine

HCID 9972061
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
651315-76-3
Standard SMILES
Clc1nc(Cl)c(-c2ccccc2)c(-c2ccccc2)n1
InChIKey
FZRKDOSESFDCBP-UHFFFAOYSA-N
Molecular formula
C16H10Cl2N2
Average molar mass
301.2 g/mol
Monoisotopic mass
300.0221037

Names & identifiers

Preferred name
2,4-Dichloro-5,6-diphenylpyrimidine
IUPAC
2,4-dichloro-5,6-diphenylpyrimidine

Names & synonyms

2,4-Dichloro-5,6-diphenylpyrimidine651315-76-3SCHEMBL1573115DTXSID70433528FZRKDOSESFDCBP-UHFFFAOYSA-NAKOS015051630

Database identifiers

CAS
651315-76-3
PubChem CID
9972061
DTXSID
DTXSID70433528

Properties

Computed structural properties

XLogP
5.4
Topological polar surface area
25.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
20
Formal charge
0
Complexity
301

Related reactions

2 records
New reaction record
HRID 941044 reaction equation
HRID 941044As reactantValidation data from https://doi.org/10.1039/C8SC04228D
HRID 2250332 reaction equation
HRID 2250332As reactantuspto-grants-2008_01

Compound notes

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