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2-Bromo-4-nitroquinoline

HCID 581266
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
20146-63-8
Standard SMILES
O=[N+]([O-])c1cc(Br)nc2ccccc12
InChIKey
UZEYIWTXAADTSC-UHFFFAOYSA-N
Molecular formula
C9H5BrN2O2
Average molar mass
253.05 g/mol
Monoisotopic mass
251.9534395

Names & identifiers

Preferred name
2-Bromo-4-nitroquinoline
IUPAC
2-bromo-4-nitroquinoline
English name
2-BROMO-4-NITROQUINOLINE
Molecular formula
C9H5BrN2O2
Molecular weight
253.05

Names & synonyms

2-Bromo-4-nitroquinoline20146-63-8DTXSID10342382RefChem:257262DTXCID70293462UZEYIWTXAADTSC-UHFFFAOYSA-N2-Bromo-4-nitroquinoline;SCHEMBL483953Quinoline, 2-bromo-4-nitro-MB06585DB-081631

Database identifiers

CAS
20146-63-8
PubChem CID
581266
DTXSID
DTXSID10342382

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
58.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
0
Heavy atoms
14
Formal charge
0
Complexity
231

Chemistry & industry

Suppliers5 total

陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
Capot Chemical Co.,Ltd.+86-(0)57185586718 +86-13336195806 · [email protected]
济南睿思医药技术有限公司0531-0531-69900633 19963472814 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]
宝鸡福诺康实业有限公司0917-3236817 13220096790 · [email protected]

Related reactions

10 records
New reaction record
HRID 326043 reaction equation
HRID 326043As reactantuspto-grants-1984_04
HRID 452314 reaction equation
HRID 452314As productuspto-grants-2013_07
HRID 452315 reaction equation
HRID 452315As reactantuspto-grants-2013_07
HRID 838010 reaction equation
HRID 838010As reactantTest data from https://doi.org/10.1039/C8SC04228D
HRID 1207038 reaction equation
HRID 1207038As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 2361465 reaction equation
HRID 2361465As productuspto-grants-2014_04
HRID 2361466 reaction equation
HRID 2361466As reactantuspto-grants-2014_04
HRID 2361491 reaction equation
HRID 2361491As reactantuspto-grants-2014_04
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Compound notes

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