Basic information
- CAS
2550-73-4- Standard SMILES
O=c1[nH]c(=O)c2cc3c(=O)[nH]c(=O)c3cc12- InChIKey
UGQZLDXDWSPAOM-UHFFFAOYSA-N- Molecular formula
- C10H4N2O4
- Average molar mass
- 216.15 g/mol
- Monoisotopic mass
- 216.01710661
Overview
RN given refers to parent cpd
Names & identifiers
- Preferred name
- Benzo(1,2-c:4,5-c')dipyrrole-1,3,5,7(2H,6H)-tetrone
- IUPAC
- pyrrolo[3,4-f]isoindole-1,3,5,7-tetrone
- English name
- PYROMELLITIC DIIMIDE
- Molecular formula
- C10H4N2O4
- Molecular weight
- 216.15
Names & synonyms
Pyromellitic diimide2550-73-4PyromellitimidePyromellitic acid diimideBenzo[1,2-c:4,5-c']dipyrrole-1,3,5,7(2H,6H)-tetrone1,2,4,5-Benzenetetracarboxylic 1,2:4,5-diimide1,2,4,5-Benzenetetracarboxylic acid diimide32XA0W314GNSC-55160Benzo(1,2-c:4,5-c')dipyrrole-1,3,5,7(2H,6H)-tetroneDTXSID4062515RefChem:565135
Show more names
Reillex 402PyromelliticdimideLABOTEST-BB LT00080694PyromelliticDiimide>Pyromellitic Acid Diamine1,2:4,5-Benzenebisdicarbimide1,2:4,5-Benzenebis(dicarbimide)
DTXCID4037320219-852-1pyrrolo[3,4-f]isoindole-1,3,5,7-tetroneMFCD00005004pyrrolo[3,4-f]isoindole-1,3,5,7(2h,6h)-tetraoneBenzene-1,2,4,5-tetracarboxylic diimidePyrrolo[3,4-f]isoindole-1,3,5,7(2H,6H)-tetroneOprea1_370668
Database identifiers
- CAS
2550-73-4
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 92.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 355
Physicochemical properties
- Melting point
- 320 °C · >320 °C(lit.)
- Density
- 1.64 g/cm3 · 1.64 g/cm3
- storage temp.
- Sealed in dry,Room Temperature
- form
- powder to crystal
- pka
- 8.51 · 8.51±0.20(Predicted)
- color
- White to Almost white
- BRN
- 214780 · 214780
- InChI
- InChI=1S/C10H4N2O4/c13-7-3-1-4-6(10(16)12-8(4)14)2-5(3)9(15)11-7/h1-2H,(H,11,13,15)(H,12,14,16)
- InChIKey
- UGQZLDXDWSPAOM-UHFFFAOYSA-N
- SMILES
- N1C(=O)C2=CC3=C(C=C2C1=O)C(=O)NC3=O
- LogP
- 0.123 · 0.123 (est)
- CAS DataBase Reference
- 2550 · 2550-73-4(CAS DataBase Reference)
- FDA UNII
- 32 XA0W314G · 32XA0W314G
- EPA Substance Registry System
- 1 · Benzo[1,2-c:4,5-c']dipyrrole-1,3,5,7(2H,6H)-tetrone (2550-73-4)
- UNSPSC Code
- 12352100 · 12352100
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
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 2925.19.4200
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 22-24/25
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzo[1,2-c:4,5-c']dipyrrole-1,3,5,7(2H,6H)-tetrone: ACTIVE
Applications
UsesPYROMELLITIC DIIMIDE is an amine organic compound that can be used as a fast-acting inhibitor of methanogenesis.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers77 total
上海康恩博医药科技有限公司（科小研试剂）400-1388-521 17510465506 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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