Basic information
- CAS
3598-30-9- Standard SMILES
Oc1ccc(-c2ccc(O)c(O)c2)cc1O- InChIKey
MZEFNGQKJROKHS-UHFFFAOYSA-N- Molecular formula
- C12H10O4
- Average molar mass
- 218.2 g/mol
- Monoisotopic mass
- 218.0579088
Names & identifiers
- Preferred name
- (1,1'-Biphenyl)-3,3',4,4'-tetrol
- IUPAC
- 4-(3,4-dihydroxyphenyl)benzene-1,2-diol
- English name
- 4-(3,4-dihydroxyphenyl)benzene-1,2-diol
- Molecular formula
- C12H10O4
- Molecular weight
- 218.21
Names & synonyms
3598-30-9[1,1'-Biphenyl]-3,3',4,4'-tetrol(1,1'-Biphenyl)-3,3',4,4'-tetrolDTXSID90189535RefChem:1049178DTXCID50112026[1,1'-Biphenyl]-3,3',4,4'-tetraol4-(3,4-dihydroxyphenyl)benzene-1,2-diol3,3',4,4'-BiphenyltetrolMFCD000387833,3',4,4'-TETRAHYDROXYBIPHENYLCHEMBL2337291
Show more names
Biphenyl-3′,3,4,4′-tetrol3,4,3',4'-Tetrahydroxydiphenyl1,1'-Biphenyl]-3,3',4,4'-tetraol3,4,3',4'-Tetrahydroxy-diphenylmethan
3,3',4,4'-TetrahydroxydiphenylNSC1333693,4,3',4'-Tetrahydroxy-1,1'-biphenyl3,4,4'-BiphenyltetrolSCHEMBL338028orb2814266Biphenyl-3',3,4,4'-tetrolMZEFNGQKJROKHS-UHFFFAOYSA-N
Database identifiers
- CAS
3598-30-9- PubChem CID
- 97579
- DTXSID
DTXSID90189535- ChEMBL
CHEMBL2337291- Nikkaji
- J689.424K
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 209
Physicochemical properties
- Melting point
- 229 · 229-230 °C
- Boiling point
- 480.1 · 480.1±45.0 °C(Predicted)
- Density
- 1.47 · 1.470±0.06 g/cm3(Predicted)
- pka
- 9.17 · 9.17±0.10(Predicted)
- form
- Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H312-H332
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362-P403+P233-P501
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
- Hazard statements
- H302-H312-H332
- Precautionary statements
- P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362-P403+P233-P501
Chemistry & industry
Applications
UsesBiphenyl-3′,3,4,4′-tetrol (BPT) is a potent Aβ40 aggregation inhibitor. Biphenyl-3′,3,4,4′-tetrol (BPT) can be used in the study of neurodegenerative diseases such as Alzheimer's disease[1].
Upstream & downstream products
Upstream raw materials
Suppliers25 total
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
成都翔才医药科技有限公司13683497877
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Compound Net Biotechnology Inc.15266686121 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Nantong HI-FUTURE Biology Co., Ltd.+86-18051384581 · [email protected]
河南利恩化工产品有限公司0371-63357898 15378766539 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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