Basic information
- CAS
736-30-1- Standard SMILES
O=[N+]([O-])c1ccc(CCc2ccc([N+](=O)[O-])cc2)cc1- InChIKey
BSNKHEKTRWNNAC-UHFFFAOYSA-N- Molecular formula
- C14H12N2O4
- Average molar mass
- 272.26 g/mol
- Monoisotopic mass
- 272.07970687
Overview
1,2-Bis(4-nitrophenyl)ethane is a stilbenoid.
Names & identifiers
- Preferred name
- 1,2-Bis(4-nitrophenyl)ethane
- IUPAC
- 1-nitro-4-[2-(4-nitrophenyl)ethyl]benzene
- English name
- 4,4'-DINITROBIBENZYL
- Molecular formula
- C14H12N2O4
- Molecular weight
- 272.26
Names & synonyms
1,2-Bis(4-nitrophenyl)ethane4,4'-Dinitrobibenzyl736-30-11,2-Bis(p-nitrophenyl)ethaneDinitro-4,4' dibenzyleBenzene, 1,1'-(1,2-ethanediyl)bis[4-nitro-p,p'-Dinitro-bibenzylUNII-SY1ZK3A4XOSY1ZK3A4XOBIS(P-NITROBENZYL)Dinitro-4,4' dibenzyle [French]EINECS 212-001-5
Show more names
NSC 608NSC 60022TIMTEC-BB SBB0079734,4'-Dinitrodibenzyl4,4’-dinitrodibenzyl4,4’-dinitro-bibenzyp,p’-dinitrobibenzylp,p’-dinitrodibenzylp,p'-Dinitrodibenzyl
Benzene, 1,1'-(1,2-ethanediyl)bis(4-nitro-NSC-608NSC-60022DTXSID2061066EC 212-001-54,4'-DINITRODIHYDROSTILBENERefChem:71719DTXCID2047567
Database identifiers
- CAS
736-30-1- PubChem CID
- 69776
- DTXSID
DTXSID2061066- ChEBI
CHEBI:34040- UNII
- SY1ZK3A4XO
- EC Number
- 212-001-5
- Nikkaji
- J193.106G
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 91.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 300
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical diffusion
Physicochemical properties
- Melting point
- 179 · 179-183 °C(lit.)
- Boiling point
- 415.31 °C · 415.31°C (rough estimate)
- Density
- 1.2499 · 1.2499 (rough estimate)
- vapor pressure
- 0.001 Pa · 0.001Pa at 20℃
- refractive index
- 1.618 · 1.6180 (estimate)
- storage temp.
- 2 · 2-8°C
- form
- Powder
- Stability
- Stable. Incompatible with strong oxidizing agents.
- LogP
- 2.8 at · 2.8 at 20℃ and pH8.2-8.5
- CAS DataBase Reference
- 736 · 736-30-1
- FDA UNII
- 1 ZK3A4XO · SY1ZK3A4XO
- EPA Substance Registry System
- 1 · Benzene, 1,1'-(1,2-ethanediyl)bis[4-nitro- (736-30-1)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 312 · H312-H413-H302-H332
- Precautionary statements
- 261 · P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P280-P302+P352-P312-P322-P363-P501
- Hazard Codes
- Xn
- Risk Statements
- 20 · 20/21/22
- Safety Statements
- 36 · 36
- WGK Germany
- 1 · 1
- RTECS
- 356000 · DA0356000
- TSCA
- TSCA listed
- HazardClass
- IRRITANT
- HS Code
- 29042000 · 29042000
- REACH Registrations
- Active
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 2.1% (1 of 48) of reports.
Warning
H302 (81.2%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 48 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory InformationREACH registered substance: p,p'-dinitrobibenzyl (EC: 212-001-5)
Hazard Classes and CategoriesAcute Tox. 4 (81.2%)
Safety data
- wgk
- 1
- tsca
- TSCA listed
- rtecs
- DA0356000
- hs_code
- 29042000
- risk_code
- 20/21/22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 36
- hazard_class
- IRRITANT
- Hazard statements
- H312-H413-H302-H332
- REACH Registrations
- Active
- Precautionary statements
- P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P280-P302+P352-P312-P322-P363-P501
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzene, 1,1'-(1,2-ethanediyl)bis[4-nitro-: ACTIVE
Upstream & downstream products
Upstream raw materials
Suppliers36 total
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
上海忝晴化工有限公司+8613816254020 · [email protected]
常州市华阳科技有限公司+8615250961469 · [email protected]
济南精合医药科技有限公司0531-88811783 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
郑州安步防护用具有限公司+86-0371-88006763; +86-15988602810 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
上海孟善化工有限公司21-58226973 18917146209 · [email protected]
ZHENGZHOU JIUYI TIME NEW MATERIALS CO,.LTD+8613676922317 · [email protected]
西安乐纯化工有限责任公司029-15596886083 15596886083 · [email protected]
OpChem(Changzhou) Co.,Ltd.+86-18112346326 · [email protected]
江西弗莱医药科技有限公司15870833005 · [email protected]
东阳市求索医药科技有限公司17502510579 · [email protected]
上海相辉医药科技有限公司[email protected]
Xuzhou B&C Chemical Technology Co., Ltd+86-400-0516-021 +86-15190678838 · [email protected]
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
ATK CHEMICAL COMPANY LIMITED+undefined-21-51877795 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
Shanghai Arbor Chemical Co., Ltd.021-60451682 · [email protected]
爆牛贸易重庆有限公司+86-023-6139-8061 +86-86-13650506873 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
杭州里德伯生物科技有限公司13616542515 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
徐州博康化学科技股份有限公司051686297676 · [email protected]
吉林中科研伸科技有限公司043180534350 19917294565 · [email protected]
Additional notes
DefinitionChEBI: 1,2-Bis(4-nitrophenyl)ethane is a stilbenoid.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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