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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.

The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.

Diss Factsheets

Reference substances

Reference substances

Currently viewing:
IUPAC name:
12H-phthaloperin-12-one

Inventory

EC number:
230-049-5
EC name:
12H-phthaloperin-12-one
CAS number:
6925-69-5
CAS number:
6925-69-5
Synonyms
Names:
12H-Phthaloperin-12-one
12h-phthaloperin-12-one
Identifier:
IUPAC name
2,11-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹⁶,²⁰]icosa-1(19),4(9),5,7,10,12(20),13,15,17-nonaen-3one
Identifier:
IUPAC name
12H-isoindolo[2,1-a]perimidin-12-one
Identifier:
IUPAC name
12H-phthaloperin-12-one
Identifier:
IUPAC name
2,11-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹⁶,²⁰]icosa-1(19),4(9),5,7,10,12(20),13,15,17-nonaen-3-one
Identifier:
IUPAC name
2,11-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹⁶,²⁰]icosa-1(19),4(9),5,7,10,12(20),13,15,17-nonaen-3one
Identifier:
other: InChl
1S/C18H10N2O/c21-18-13-8-2-1-7-12(13)17-19-14-9-3-5-11-6-4-10-15(16(11)14)20(17)18/h1-10H
Identifier:
other: SMILES notation
C1=CC=C2C(=C1)C3=NC4=CC=CC5=C4C(=CC=C5)N3C2=O
Identifier:
other: InChl
InChI=1/C18H10N2O/c21-18-13-8-2-1-7-12(13)17-19-14-9-3-5-11-6-4-10-15(16(11)14)20(17)18/h1-10H
Identifier:
other: InChl
InChI=1S/C18H10N2O/c21-18-13-8-2-1-7-12(13)17-19-14-9-3-5-11-6-4-10-15(16(11)14)20(17)18/h1-10H
Identifier:
other: SMILES notation
O=C1N2C(=Nc3cccc4cccc2c34)c5ccccc15
Identifier:
other: SMILES notation
O=C1N2c3c4c(cccc4N=C2c2ccccc12)ccc3
12H-phthaloperin-12-one

Molecular and structural information

Molecular formula:
C18H10N2O
Molecular weight:
270.29
SMILES notation:
O=C1N2c3c4c(cccc4N=C2c2ccccc12)ccc3
InChl:
1S/C18H10N2O/c21-18-13-8-2-1-7-12(13)17-19-14-9-3-5-11-6-4-10-15(16(11)14)20(17)18/h1-10H
Structural formula:
Chemical structure

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