HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

1,1,2,2-Tetrakis(4'-nitro-[1,1'-biphenyl]-4-yl)ethene

HCID 178797697
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
2177279-46-6
Standard SMILES
O=[N+]([O-])c1ccc(-c2ccc(C(=C(c3ccc(-c4ccc([N+](=O)[O-])cc4)cc3)c3ccc(-c4ccc([N+](=O)[O-])cc4)cc3)c3ccc(-c4ccc([N+](=O)[O-])cc4)cc3)cc2)cc1
InChIKey
LUBCZMORHRHDPE-UHFFFAOYSA-N
Molecular formula
C50H32N4O8
Average molar mass
816.8 g/mol

Names & identifiers

Preferred name
1,1,2,2-Tetrakis(4'-nitro-[1,1'-biphenyl]-4-yl)ethene
IUPAC
1-(4-nitrophenyl)-4-[1,2,2-tris[4-(4-nitrophenyl)phenyl]ethenyl]benzene
English name
1,1'-Biphenyl, 4,4'',4'''',4''''''-(1,2-ethenediylidene)tetrakis[4'-nitro-
Molecular formula
C50H32N4O8
Molecular weight
816.81

Names & synonyms

1,1,2,2-Tetrakis(4'-nitro-[1,1'-biphenyl]-4-yl)ethene2177279-46-6CS-0170545H418451,1'-Biphenyl, 4,4'',4'''',4''''''-(1,2-ethenediylidene)tetrakis[4'-nitro-1,?1'-?Biphenyl, 4,?4'',?4'''',?4''''''-?(1,?2-?ethenediylidene)?tetrakis[4'-?nitro-

Database identifiers

CAS
2177279-46-6

Properties

Computed structural properties

XLogP
13.8
Topological polar surface area
183 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
8
Heavy atoms
62
Formal charge
0
Complexity
1,290

Physicochemical properties

Boiling point
923.4 · 923.4±65.0 °C(Predicted)
Density
1.33 · 1.330±0.06 g/cm3(Predicted)

Chemistry & industry

Suppliers13 total

郑州德元凯化工有限公司17837139533 · [email protected]
吉林中科研伸科技有限公司0431-80534353 19917294565 · [email protected]
上海大然化学有限公司021-64478606 15900664856 · [email protected]
郑州汇聚化工有限公司0371-55900031 18137872243 · [email protected]
CHEMSOON CO.,LTD.+8613761723174 · [email protected]
吉林中科研伸科技有限公司0431-80534350 15044023330 · [email protected]
河南普赛化工产品有限公司0371-60919097 15378766539 · [email protected]
吉林省研伸科技有限公司0431-80514535 13634302652 · [email protected]
上海楷树化学科技有限公司021-51987688803-803 18916626396 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
江苏艾康生物医药研发有限公司17714375163 · [email protected]
郑州研德生物科技有限公司13298105281 · [email protected]
郑州浩创新材料有限公司19139721821; 19139721821 · [email protected]

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes