Basic information
- CAS
6312-48-7- Standard SMILES
CN1CCN(C2=C(Cl)C(=O)c3ccccc3C2=O)CC1- InChIKey
GUNUJEHGUYLPRR-UHFFFAOYSA-N- Molecular formula
- C15H15ClN2O2
- Average molar mass
- 290.74 g/mol
- Monoisotopic mass
- 290.0822054
Names & identifiers
- Preferred name
- 2-Chloro-3-(4-methylpiperazin-1-yl)naphthalene-1,4-dione
- IUPAC
- 2-chloro-3-(4-methylpiperazin-1-yl)naphthalene-1,4-dione
- English name
- 2-CHLORO-3-(4-METHYLPIPERAZINO)NAPHTHOQUINONE
- Molecular formula
- C15H15ClN2O2
- Molecular weight
- 290.74
Names & synonyms
6312-48-72-Chloro-3-(4-methylpiperazin-1-yl)naphthalene-1,4-dione2-chloro-3-(4-methylpiperazino)naphthoquinone2-chloro-3-(4-methylpiperazin-1-yl)-1,4-dihydronaphthalene-1,4-dioneMLS002608219NSC40342MFCD009489572-Chloro-3-(4-methylpiperazin-1-yl)naphthoquinoneNaphthoquinone, 2-chloro-3-(4-methylpiperazin-1-yl)-SMR001526970cid_237102SCHEMBL8651868
Show more names
1,4-Naphthalenedione, 2-chloro-3-(4-methyl-1-piperazinyl)-
CHEMBL1163377BDBM80987DTXSID70212456HMS3078I08NSC 40342NSC-40342STK535899AKOS005467112
Database identifiers
- CAS
6312-48-7- PubChem CID
- 237102
- DTXSID
DTXSID70212456- ChEMBL
CHEMBL1163377
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 40.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 466
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- HS Code
- 2933599590 · 2933599590
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2933599590
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers5 total
Carbone Scientific CO., LTD[email protected]
Ryan Scientific, Inc.[email protected]
BIONET-INTER[email protected]
MATRIX[email protected]
3B Scientific Corporation[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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