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882856-62-4 molecular structure
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2-bromopyrazino[2,3-b][1,4]diazine

ChemBase ID: 310078
Molecular Formular: C6H3BrN4
Molecular Mass: 211.01882
Monoisotopic Mass: 209.95410812
SMILES and InChIs

SMILES:
n1c2c(ncc1Br)nccn2
Canonical SMILES:
Brc1cnc2c(n1)nccn2
InChI:
InChI=1S/C6H3BrN4/c7-4-3-10-5-6(11-4)9-2-1-8-5/h1-3H
InChIKey:
MMWCCMIZTSDIKQ-UHFFFAOYSA-N

Cite this record

CBID:310078 http://www.chembase.cn/molecule-310078.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-bromopyrazino[2,3-b][1,4]diazine
IUPAC Traditional name
2-bromopyrazino[2,3-b][1,4]diazine
Synonyms
2-bromopyrazino[2,3-b]pyrazine
CAS Number
882856-62-4

DATA SOURCES

DATA SOURCES

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Data Source Data ID
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Data Source Data ID Price
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Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 0.4880168  LogD (pH = 7.4) 0.48801726 
Log P 0.48801726  Molar Refractivity 44.7472 cm3
Polarizability 15.994178 Å3 Polar Surface Area 51.56 Å2

PROPERTIES

PROPERTIES

Bioassay(PubChem)

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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