HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

Nitronaphthoquinone

HCID 54551
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
80267-67-0
Standard SMILES
O=C1C=CC(=O)c2cc([N+](=O)[O-])ccc21
InChIKey
XDIWXFTZTJQXDE-UHFFFAOYSA-N
Molecular formula
C10H5NO4
Average molar mass
203.15 g/mol
Monoisotopic mass
203.02185764

Names & identifiers

Preferred name
Nitronaphthoquinone
IUPAC
6-nitronaphthalene-1,4-dione
English name
6-nitronaphthalene-1,4-dione
Molecular formula
C10H5NO4
Molecular weight
0

Names & synonyms

6-nitronaphthalene-1,4-dioneNITRONAPHTHOQUINONE58200-82-11,4-Naphthalenedione, 6-nitro-80267-67-06-nitro-1,4-naphthoquinone6-nitronaphthoquinonestarbld0019596SCHEMBL9158448DTXSID40230203XDIWXFTZTJQXDE-UHFFFAOYSA-N

Database identifiers

CAS
80267-67-0
PubChem CID
54551
DTXSID
DTXSID40230203

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
80 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
0
Heavy atoms
15
Formal charge
0
Complexity
355

Chemistry & industry

Suppliers1 total

常州安赛普化工有限公司0519-86305871 · [email protected]

Related reactions

3 records
New reaction record
HRID 1077334 reaction equation
HRID 1077334As reactantuspto-grants-1976_05
HRID 1077335 reaction equation
HRID 1077335As reactantuspto-grants-1976_05
HRID 1283447 reaction equation
HRID 1283447As reactantuspto-grants-1976_08

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes