chempirical

Pigment black 32

C40H26N2O6CAS 83524-75-8630.66 g/mol

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AmideEtherLactam

Properties

Molecular formula
C40H26N2O6
Molar mass
630.66 g/mol
Exact mass
630.1791 Da
Melting point
187–188 °C
logP
7.35Crippen estimate
Polar surface area
93.2 Ų
H-bond donors / acceptors
0 / 6
Rotatable bonds
6

Hazards

Warning
Irritant (GHS07)

Aggregated from 154 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
83524-75-8
SMILES
COc1ccc(CN2C(=O)c3ccc4c5ccc6c7c(ccc(c8ccc(c3c48)C2=O)c75)C(=O)N(Cc2ccc(OC)cc2)C6=O)cc1
InChIKey
LQDAMBYDGRGJGA-UHFFFAOYSA-N
InChI
InChI=1S/C40H26N2O6/c1-47-23-7-3-21(4-8-23)19-41-37(43)29-15-11-25-27-13-17-31-36-32(40(46)42(39(31)45)20-22-5-9-24(48-2)10-6-22)18-14-28(34(27)36)26-12-16-30(38(41)44)35(29)33(25)26/h3-18H,19-20H2,1-2H3

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Names and synonyms

12 names
  • Anthra[2,1,9-def:6,5,10-d'e'f′]diisoquinoline-1,3,8,10(2H,9H)-tetrone, 2,9-bis[(4-methoxyphenyl)methyl]-
  • 2,9-Bis[(4-methoxyphenyl)methyl]anthra[2,1,9-def:6,5,10-d'e'f′]diisoquinoline-1,3,8,10(2H,9H)-tetrone
  • N,N′-Bis(4-methoxybenzyl)perylene-3,4:9,10-bis(dicarboximide)
  • C.I. 71133
  • C.I. Pigment black 32
  • Paliogen black L 0086
  • PDI-32
  • HPP Black 8230
  • N,N′-Bis(4-methoxybenzyl)perylene-3,4,9,10-bis(dicarboximide)
  • Black L 0086
  • 2,9-Bis(4-methoxybenzyl)anthra[2,1,9-def:6,5,10-d'e'f′]diisoquinoline-1,3,8,10(2H,9H)-tetraone
  • Perylene black 32

Work with Pigment black 32

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Pigment red 1906424-77-764 % similar Pigment red 1795521-31-346 % similar 2-(Phenylmethyl)-1H-isoindole-1,3(2H)-dione2142-01-044 % similar 4-Methoxyphenylacetone122-84-941 % similar (4-Methoxyphenyl)acetic acid104-01-840 % similar 4-(4-Methoxyphenyl)-2-butanone104-20-140 % similar 1,2-Bis(4-methoxyphenyl)ethanone120-44-540 % similar Methyl 4-methoxybenzeneacetate23786-14-340 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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