Basic information
- CAS
4371-27-1- Standard SMILES
O=C(O)c1cccc(C(=O)O)c1-c1c(C(=O)O)cccc1C(=O)O- InChIKey
YENVMPPRTXICRT-UHFFFAOYSA-N- Molecular formula
- C16H10O8
- Average molar mass
- 330.24 g/mol
- Monoisotopic mass
- 330.03756727
Names & identifiers
- Preferred name
- [1,1'-Biphenyl]-2,2',6,6'-tetracarboxylic acid
- IUPAC
- 2-(2,6-dicarboxyphenyl)benzene-1,3-dicarboxylic acid
- English name
- NSC408156
- Molecular formula
- C16H10O8
- Molecular weight
- 330.25
Names & synonyms
4371-27-1[1,1'-Biphenyl]-2,2',6,6'-tetracarboxylic acid[1,1'-Biphenyl]-2,2',6,6'-tetracarboxylicacid2-(2,6-dicarboxyphenyl)benzene-1,3-dicarboxylic acidNSC408156SCHEMBL203394orb3215853DTXSID80324998DK7245MFCD30542696biphenyl-22'66'-tetracarboxylic acidNSC-408156
Show more names
biphenyl-2，2'，6，6'-tetracarboxylic acid
2,2',6,6'-biphenyltetracarboxylic acidBS-51529biphenyl-2,6,2',6'-tetracarboxylic acidCS-0110081F769061,1'-Biphenyl]-2,2',6,6'-tetracarboxylic acidF606543
Database identifiers
- CAS
4371-27-1- PubChem CID
- 348703
- DTXSID
DTXSID80324998- Nikkaji
- J1.125.076I
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 149 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 450
Physicochemical properties
- Melting point
- 390 °C · 390 °C (decomp)
- Boiling point
- 561.2 · 561.2±50.0 °C(Predicted)
- Density
- 1.612 · 1.612±0.06 g/cm3(Predicted)
- pka
- 2.73 · 2.73±0.36(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
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-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers40 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
上海药诚医药科技合伙企业（有限合伙）400-6181121 18616381138 · [email protected]
上海卡伦姆生化科技有限公司15837198050 · [email protected]
郑州德元凯化工有限公司17837139533 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
郑州研德生物科技有限公司0371-63682289 15538176268 · [email protected]
常州鹏森福新材料科技有限公司18961278960 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
安庆东禾生物技术有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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