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N-(1,3-dioxoisoindol-2-yl)benzamide

HCID 690733
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
16067-65-5
Standard SMILES
O=C(NN1C(=O)c2ccccc2C1=O)c1ccccc1
InChIKey
QDRKIFVTZFDQDJ-UHFFFAOYSA-N
Molecular formula
C15H10N2O3
Average molar mass
266.25 g/mol
Monoisotopic mass
266.06914219

Names & identifiers

Preferred name
N-(1,3-dioxoisoindol-2-yl)benzamide
IUPAC
N-(1,3-dioxoisoindol-2-yl)benzamide
English name
Benzamide, N-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-
Molecular formula
C15H10N2O3
Molecular weight
266.25

Names & synonyms

16067-65-5N-(1,3-dioxoisoindol-2-yl)benzamideDTXSID50351099RefChem:359828DTXCID90302166N-(1,3-Dioxoisoindolin-2-yl)benzamideN-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzamideN-phthalimidobenzamideTimTec1_000761SCHEMBL11817094SCHEMBL30423816QDRKIFVTZFDQDJ-UHFFFAOYSA-N
Show more names
Benzamide, N-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-
HMS1536C13STK391551AKOS000422174NCGC00175148-01ST009491N-(1,3-dioxobenzo[c]azolin-2-yl)benzamideBRD-K29624569-001-01-0N-(1,3-DIOXO-1,3-DIHYDRO-ISOINDOL-2-YL)-BENZAMIDE

Database identifiers

CAS
16067-65-5
PubChem CID
690733
DTXSID
DTXSID50351099
EC Number
163-705-3
Nikkaji
J929.236E

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
66.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
20
Formal charge
0
Complexity
405

Physicochemical properties

Melting point
218 °C · 218 °C
Density
1.43 · 1.43±0.1 g/cm3(Predicted)
pka
9.37 · 9.37±0.20(Predicted)

Chemistry & industry

Suppliers6 total

吉林中科研伸科技有限公司18143011203 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
山东利腾生物科技有限公司15020019777 18663721413 · [email protected]
上海睿升化工科技有限公司15026594951 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
江苏新素新材料有限公司0512-66387919 15251950002 · [email protected]

Related reactions

2 records
New reaction record
HRID 1658456 reaction equation
HRID 1658456As productuspto-grants-1976_06
HRID 2123904 reaction equation
HRID 2123904As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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