Basic information
- CAS
12236-62-3- Standard SMILES
CC(=O)C(N=Nc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1- InChIKey
DLQMNSDNQWLFSS-UHFFFAOYSA-N- Molecular formula
- C17H13ClN6O5
- Average molar mass
- 416.8 g/mol
- Monoisotopic mass
- 416.0635952
Names & identifiers
- Preferred name
- C.I. Pigment Orange
- IUPAC
- 2-[(4-chloro-2-nitrophenyl)diazenyl]-3-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)butanamide
- English name
- Pigment Orange 36
- Molecular formula
- C17H13ClN6O5
- Molecular weight
- 416.78
Names & synonyms
12236-62-3Permanent Orange HLPV Orange HLHSDB 39022-[(4-Chloro-2-nitrophenyl)azo]-N-(2,3-dihydro-2-oxo-1H-benzimidazol-5-yl)-3-oxobutyramideEINECS 235-462-4NOVOPERM ORANGE HLDTXSID9041732EC 235-462-4Butanamide, 2-((4-chloro-2-nitrophenyl)azo)-N-(2,3-dihydro-2-oxo-1H-benzimidazol-5-yl)-3-oxo-2-((4-Chloro-2-nitrophenyl)azo)-N-(2,3-dihydro-2-oxo-1H-benzimidazol-5-yl)-3-oxobutyramideButanamide, 2-(2-(4-chloro-2-nitrophenyl)diazenyl)-N-(2,3-dihydro-2-oxo-1H-benzimidazol-5-yl)-3-oxo-
Show more names
c.i. 11780Orange HLP-orange 36Pigment Orange 36CIPIGMETNORANGE36Orange pigment 36.permanent orange hslC.I. Pigment Orange 36
ACETOACETAMIDE, 2-((4-CHLORO-2-NITROPHENYL)AZO)-N-(2-OXO-5-BENZIMIDAZOLINYL)-235-462-4Butanamide, 2-[(4-chloro-2-nitrophenyl)azo]-N-(2,3-dihydro-2-oxo-1H-benzimidazol-5-yl)-3-oxo-Butanamide, 2-[2-(4-chloro-2-nitrophenyl)diazenyl]-N-(2,3-dihydro-2-oxo-1H-benzimidazol-5-yl)-3-oxo-RefChem:572519DTXCID10809985Butanamide, 2((4chloro2nitrophenyl)azo)N(2,3dihydro2oxo1Hbenzimidazol5yl)3oxoBUTANAMIDE, 2-((4-CHLORO-2-NITROPHENYL)AZO)-N-(2,3-DIHYDRO-2-OXO-1H-BENZIMIDA ZOL-5-YL)-3-OXO-
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 158 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 713
Experimental & physicochemical properties
Chemical ClassesDyes -> Azo Dyes
Polymers
Plastics -> Pigments agents
Plastics -> Polyolefin-I; PUR; Polyolefin-II; PVC (soft); ABS; PVC (rigid); PET; PMMA; PA; PC; (E)PS
Physical Description
CBI; Dry Powder; Wet Solid; Dry Powder
Reddish-orange aqueous paste or powder; [MSDSonline]
Physicochemical properties
- Boiling point
- 544.1 · 544.1±50.0 °C(Predicted)
- Density
- 1.66 · 1.66±0.1 g/cm3(Predicted)
- pka
- 0.45 · 0.45±0.59(Predicted)
- LogP
- 0.79 at · 0.79 at 24℃ and pH7
- CAS DataBase Reference
- 12236 · 12236-62-3(CAS DataBase Reference)
- FDA UNII
- 649 L6L708A · 649L6L708A
- EPA Substance Registry System
- 36 · C.I. Pigment Orange 36 (12236-62-3)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (370 of 370) of all reports.
Not Classified
Aggregated GHS information provided per 370 reports by companies from 2 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory Information
Chemical: Butanamide, 2-[(4-chloro-2-nitrophenyl)azo]-N-(2,3-dihydro-2-oxo-1H-benzimidazol-5-yl)-3-oxo-
Butanamide, 2-[2-(4-chloro-2-nitrophenyl)diazenyl]-N-(2,3-dihydro-2-oxo-1H-benzimidazol-5-yl)-3-oxo- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Butanamide, 2-[2-(4-chloro-2-nitrophenyl)diazenyl]-N-(2,3-dihydro-2-oxo-1H-benzimidazol-5-yl)-3-oxo- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Status: Active Update: 07-09-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/14130
Butanamide, 2-[(4-chloro-2-nitrophenyl)azo]-N-(2,3-dihydro-2-oxo-1H-benzimidazol-5-yl)-3-oxo-: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - Butanamide, 2-[(4-chloro-2-nitrophenyl)azo]-N-(2,3-dihydro-2-oxo-1H-benzimidazol-5-yl)-3-oxo-: Human health tier I assessment
Hazards SummaryIn general, organic pigments are practically non-toxic; Oral LD50 in rats is >5,000 mg/kg; [MSDSonline]
Hazard Classes and CategoriesNot Classified
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
UsesPlastics -> Typical concentration range in plastic materials -> 2%
U.S. Production2023: 50,000 - <250,000 lb
Consumer UsesPigment
Industry UsesPigment
Use Classification
Plastics -> Pigments agents
Plastics -> Polymer Type -> Polyolefin-I; PUR; Polyolefin-II; PVC (soft); ABS; PVC (rigid); PET; PMMA; PA; PC; (E)PS
General Manufacturing Information
Electrical Equipment, Appliance, and Component Manufacturing
Butanamide, 2-[2-(4-chloro-2-nitrophenyl)diazenyl]-N-(2,3-dihydro-2-oxo-1H-benzimidazol-5-yl)-3-oxo-: ACTIVE
Applications
Usespigment orange 36 is transparent reddish orange, excellent light and weather fastness, suited for automobile paint with good flow. Glossy is not affected when increasing the pigment concentration. Used for packaging ink. Shows good solvent resistance, excellent light resistance in metal decorative ink medium.
Suppliers31 total
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
山东洛克化工有限公司17653113209 13065062079 · [email protected]
Related reactions
2 records
Compound notes
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