Basic information
- CAS
947686-05-7- Standard SMILES
C=CCc1ccc(O)c(-c2cc(CC=C)ccc2O)c1.C=CCc1ccc(O)c(-c2ccc(O)c(CC=C)c2)c1- InChIKey
AHDXDAUDZWEXCN-UHFFFAOYSA-N- Molecular formula
- C36H36O4
- Average molar mass
- 532.7 g/mol
- Monoisotopic mass
- 532.26135963
Overview
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Names & identifiers
- Preferred name
- 2-(2-Hydroxy-5-prop-2-enylphenyl)-4-prop-2-enylphenol;2-(4-hydroxy-3-prop-2-enylphenyl)-4-prop-2-enylphenol
- IUPAC
- 2-(2-hydroxy-5-prop-2-enylphenyl)-4-prop-2-enylphenol;2-(4-hydroxy-3-prop-2-enylphenyl)-4-prop-2-enylphenol
- English name
- Reaction mass of 3',5-diallyl[biphenyl]-2,4'-diol and 5,5'-diallyl[biphenyl]-2,2'-diol
- Molecular formula
- C36H36O4
- Molecular weight
- 532.68
Names & synonyms
947686-05-7SCHEMBL527731DTXSID9013777803',5-bis(prop-2-en-1-yl)-[1,1'-biphenyl]-2,4'-diol; 5,5'-bis(prop-2-en-1-yl)-[1,1'-biphenyl]-2,2'-diol3',5-(5,5'-)Diallyl-[1,1'-biphenyl]-2,4'-(2,2'-)diolReaction mass of 3',5-diallyl[biphenyl]-2,4'-diol and 5,5'-diallyl[biphenyl]-2,2'-diol3',5-Diallyl-[1,1'-biphenyl]-2,4'-diol compound with 5,5'-diallyl-[1,1'-biphenyl]-2,2'-diol3',5-Diallyl-[1,1'-biphenyl]-2,4'-diol compound with 5,5'-diallyl-[1,1'-biphenyl]-2,2'-diol (1:1)
Database identifiers
- CAS
947686-05-7- PubChem CID
- 11635144
- DTXSID
DTXSID901377780
Properties
Computed structural properties
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 619
Physicochemical properties
- Boiling point
- 400 ℃ · 400℃ at 1.013hPa
- Density
- 1.15 at · 1.15 at 20℃
- vapor pressure
- 0.001 · 0.001-0.002Pa at 30-45℃
- form
- Solid
- LogP
- 4.24 at · 4.24 at 25℃ and pH7
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 315 · H315-H335-H319-H411-H317
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362
- 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.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- Hazard statements
- H315-H335-H319-H411-H317
- REACH Registrations
- Active
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Suppliers3 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]
长沙上禾生物科技有限公司0731-84213302 18975842720 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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