Basic information
- CAS
2042511-09-9- Standard SMILES
O=Cc1ccc(-c2ccc(-c3cc(-c4ccccn4)nc(-c4ccccn4)c3)cc2)cc1- InChIKey
CHVUIAWHNKWDLT-UHFFFAOYSA-N- Molecular formula
- C28H19N3O
- Average molar mass
- 413.5 g/mol
Names & identifiers
- Preferred name
- 4'-([2,2':6',2"-Terpyridin]-4'-yl)-[1,1'-biphenyl]-4-carbaldehyde
- IUPAC
- 4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]benzaldehyde
- English name
- 4'-([2,2':6',2"-terpyridin]-4'-yl)-[1,1'-biphenyl]-4-carbaldehyde
- Molecular formula
- C28H19N3O
- Molecular weight
- 413.47
Names & synonyms
2042511-09-94'-([2,2':6',2"-Terpyridin]-4'-yl)-[1,1'-biphenyl]-4-carbaldehyde4'-([2,2':6',2''-Terpyridin]-4'-yl)-[1,1'-biphenyl]-4-carbaldehydeCS-0170212[1,1'-Biphenyl]-4-carboxaldehyde, 4'-[2,2':6',2''-terpyridin]-4'-yl-
Database identifiers
- CAS
2042511-09-9- Nikkaji
- J3.602.923D
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 55.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 555
Physicochemical properties
- Boiling point
- 626.3 · 626.3±55.0 °C(Predicted)
- Density
- 1.209 · 1.209±0.06 g/cm3(Predicted)
- pka
- 4.54 · 4.54±0.22(Predicted)
Chemistry & industry
Suppliers10 total
郑州德元凯化工有限公司17837139533 · [email protected]
河南东元化工科技有限公司16696119288 · [email protected]
吉林中科研伸科技有限公司0431-80534353 19917294565 · [email protected]
上海凯睿生物科技有限公司021-5068 3667/17749785980/1029026415; 17749785980 · [email protected]
山东弗珍化学科技有限公司13146841504 · [email protected]
郑州汇聚化工有限公司0371-55900031 18137872243 · [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]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
郑州浩创新材料有限公司19139721821; 19139721821 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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