Basic information
- CAS
47162-00-5- Standard SMILES
CCCCCCCC(=O)c1ccc(-c2ccccc2)cc1- InChIKey
JSNGEMRLSPQOOF-UHFFFAOYSA-N- Molecular formula
- C20H24O
- Average molar mass
- 280.4 g/mol
- Monoisotopic mass
- 280.18271539
Names & identifiers
- Preferred name
- 4-n-Octanoylbiphenyl
- IUPAC
- 1-(4-phenylphenyl)octan-1-one
- English name
- 4-N-OCTANOYLBIPHENYL
- Molecular formula
- C20H24O
- Molecular weight
- 280.4
Names & synonyms
4-n-Octanoylbiphenyl47162-00-51-(4-phenylphenyl)octan-1-one1-([1,1'-Biphenyl]-4-yl)octan-1-oneMFCD001433584-Octanoylbiphenyl1-Biphenyl-4-yl-octan-1-oneSCHEMBL10282853DTXSID40345821JSNGEMRLSPQOOF-UHFFFAOYSA-NAKOS009159055SY054675
Show more names
4-N-OCTANOYLDIPHENYL4-n-Octanoylbiphenyl>4-n-Octanoylbiphenyl1-(4-Biphenylyl)-1-octanone1-Octanone, 1-[1,1'-biphenyl]-4-yl-
1-[1,1'-Biphenyl]-4-yl-1-octanone #O0214D91834F8760904-n-Octanoylbiphenyl, inverted exclamation markO97%
Database identifiers
- CAS
47162-00-5- PubChem CID
- 607296
- DTXSID
DTXSID40345821- Nikkaji
- J236.195G
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 8
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 282
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical structure
Physicochemical properties
- Melting point
- 100 °C · 100 °C
- Boiling point
- 200 °C · 200 °C / 3mmHg
- Density
- 0.982 · 0.982±0.06 g/cm3(Predicted)
- solubility
- almost transparency in Toluene
- form
- powder to crystal
- color
- White to Almost white
- CAS DataBase Reference
- 47162 · 47162-00-5
- Symbol(GHS)
- 7 · GHS07,GHS08,GHS09
- Signal word
- Danger
- Hazard statements
- 302 · H302-H361-H372-H410
- Precautionary statements
- 201 · P201-P264-P280-P301+P330+P331-P312
- HS Code
- 2914.39 · 2914.39.9000
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2914.39.9000
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS08,GHS09
- Hazard statements
- H302-H361-H372-H410
- Precautionary statements
- P201-P264-P280-P301+P330+P331-P312
Chemistry & industry
Suppliers21 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]
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]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
菏泽博纳医药科技有限公司15865805009 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
上海敏寒医药科技有限公司17612188245 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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