Basic information
- CAS
613-42-3- Standard SMILES
c1ccc(Cc2ccc(-c3ccccc3)cc2)cc1- InChIKey
AGPLQTQFIZBOLI-UHFFFAOYSA-N- Molecular formula
- C19H16
- Average molar mass
- 244.3 g/mol
- Monoisotopic mass
- 244.12520051
Names & identifiers
- Preferred name
- p-Benzylbiphenyl
- IUPAC
- 1-benzyl-4-phenylbenzene
- English name
- 4-Benzylbiphenyl
- Molecular formula
- C19H16
- Molecular weight
- 244.33
Names & synonyms
613-42-3p-benzylbiphenyl4-(Phenylmethyl)-1,1'-biphenyl7NM7FB925TNSC-59812DTXSID50210197RefChem:1094167DTXCID50132688210-341-94-Benzylbiphenyl1-benzyl-4-phenylbenzene4-Benzyl-1,1'-biphenyl
Show more names
BENZYLBIPHENYL4-Benzyldiphenylbiphenyl,4-benzyl-benzylphenylbenzene4-Benzylbiphenyl,98%4-Benzylbiphenyl >4-Benzylbiphenyl ,97%
4-PhenyldiphenylmethaneMFCD000418311,1'-Biphenyl, 4-(phenylmethyl)-NSC59812STK011799AKOS005376739AS-46995CS-0206856
Database identifiers
- CAS
613-42-3- PubChem CID
- 69174
- DTXSID
DTXSID50210197- UNII
- 7NM7FB925T
- EC Number
- 210-341-9
- Nikkaji
- J60.902A
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 237
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Melting point
- 85 · 85-87 °C(lit.)
- Boiling point
- 285 · 285-286°C 110mm
- Density
- 1.171 · 1.1710
- refractive index
- 1.5839 · 1.5839 (estimate)
- Flash point
- 208 °C · 208°C
- storage temp.
- Store at room temperature
- solubility
- soluble in Benzene
- form
- powder to crystal
- color
- White to Almost white
- BRN
- 2047066 · 2047066
- CAS DataBase Reference
- 613 · 613-42-3(CAS DataBase Reference)
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
- wgk
- 1
- hs_code
- 2902.90.3050
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 24/25
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P330-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers82 total
上海康恩博医药科技有限公司（科小研试剂）400-1388-521 17510465506 · [email protected]
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]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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