Basic information
- CAS
4316-57-8- Standard SMILES
O=[N+]([O-])c1ccc(N(c2ccccc2)c2ccccc2)cc1- InChIKey
UQOKZDUUBVGFAK-UHFFFAOYSA-N- Molecular formula
- C18H14N2O2
- Average molar mass
- 290.3 g/mol
- Monoisotopic mass
- 290.10552769
Names & identifiers
- Preferred name
- 4-Nitrotriphenylamine
- IUPAC
- 4-nitro-N,N-diphenylaniline
- English name
- 4-Nitrophenyl diphenylamine
- Molecular formula
- C18H14N2O2
- Molecular weight
- 290.32
Names & synonyms
4-NitrotriphenylamineRefChem:526034678-311-14-Nitro-N,N-diphenylaniline4316-57-84-Nitrophenyl diphenylamineC18H14N2O2MFCD00814232(4-Nitrophenyl)diphenylamine4-nitro-N,N-diphenyl-anilineMLS000577562AKOS015964509
Show more names
NSC 5074914-nitrotrophenylamine4-NITRO-TRIPHENYLAMINE4-Nitrotriphenylamine>N,N-Diphenyl-4-nitroaniline(p-Nitrophenyl)diphenylaMineN-(4-Nitrophenyl)-N,N-diphenylaMine
CS-W012194AS-47887SMR000185555SY056308F16692Benzenamine, 4-nitro-N,N-diphenyl-p-nitrotriphenylamineNSC507491
Database identifiers
- CAS
4316-57-8- PubChem CID
- 350141
- DTXSID
DTXSID60325443- ChEMBL
CHEMBL1370844- EC Number
- 678-311-1
- Nikkaji
- J794.027K
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 49.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 331
Experimental & physicochemical properties
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
Physicochemical properties
- Melting point
- 141 · 141-143°C
- Boiling point
- 452.6 · 452.6±28.0 °C(Predicted)
- Density
- 1.249 · 1.249±0.06 g/cm3(Predicted)
- storage temp.
- 2 · Sealed in dry,2-8°C
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- form
- Solid
- pka
- -6.22 · -6.22±0.30(Predicted)
- color
- Dark Yellow to Dark Orange
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301+H311+H331
- Precautionary statements
- 261 · P261-P280-P301+P310-P311
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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 2921.49.5000
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- Hazard statements
- H301+H311+H331
- Precautionary statements
- P261-P280-P301+P310-P311
Chemistry & industry
Applications
Uses4-Nitrophenyl Diphenylamine (cas# 4316-57-8) is a compound useful in organic synthesis.
Upstream & downstream products
Downstream products
Suppliers82 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
苏州启航生物科技有限公司18151111370 · [email protected]
陕西星贝爱科生物科技有限责任公司029-13572876172 13572876172 · [email protected]
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
武汉易泰科技有限公司上海分公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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