Basic information
- CAS
4371-28-2- Standard SMILES
O=C(O)c1cc(C(=O)O)cc(-c2cc(C(=O)O)cc(C(=O)O)c2)c1- InChIKey
QURGMSIQFRADOZ-UHFFFAOYSA-N- Molecular formula
- C16H10O8
- Average molar mass
- 330.24 g/mol
- Monoisotopic mass
- 330.03756727
Names & identifiers
- Preferred name
- Biphenyl-3,3',5,5'-tetracarboxylic Acid
- IUPAC
- 5-(3,5-dicarboxyphenyl)benzene-1,3-dicarboxylic acid
- English name
- Biphenyl-3,3',5,5'-tetracarboxylic acid
- Molecular formula
- C16H10O8
- Molecular weight
- 330.25
Names & synonyms
Biphenyl-3,3',5,5'-tetracarboxylic acidRefChem:568388687-332-54371-28-2[1,1'-Biphenyl]-3,3',5,5'-tetracarboxylic acidMFCD16621475Biphenyl-3,3,5,5-tetracarboxylic acid5-(3,5-dicarboxyphenyl)benzene-1,3-dicarboxylic acid3,3',5,5'-Blphenyltetracarboxylic acidSCHEMBL145349AU-004/43508027[1,1'-biphenyl]3,3',5,5'-tetracarboxylic acid
Show more names
DK7660DK72323,3',5,5'-biphenyltetramacetic acidBiphenyl-3,3',5,5'-tetracarboxylicaci3,3',5,5'-BiphenyltetracarboxylicacidBiphenyl-3,3',5,5'-tetracarboxylic Acid >[1,1'-biphenyl]-3,3',5,5'-tetracarboxylicacid1,1'-Biphenyl]-3,3',5,5'-tetracarboxylic acid
[1,1'-biphenyl]-3,3',5,5'-tetracarboxylicacidorb3213650DTXSID60578790AKOS007930836CS-W018437DS-53783,3',5,5'-biphenyltetracarboxylic acidSY053019
Database identifiers
- CAS
4371-28-2- PubChem CID
- 15840397
- DTXSID
DTXSID60578790- EC Number
- 687-332-5
- Nikkaji
- J672.634H
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
- 400 ℃ · >400℃
- Boiling point
- 772.3 · 772.3±60.0 °C(Predicted)
- Density
- 1.612 · 1.612±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- pka
- 3.06 · 3.06±0.10(Predicted)
- form
- solid
- color
- White to Almost white
- InChI
- InChI=1S/C16H10O8/c17-13(18)9-1-7(2-10(5-9)14(19)20)8-3-11(15(21)22)6-12(4-8)16(23)24/h1-6H,(H,17,18)(H,19,20)(H,21,22)(H,23,24)
- InChIKey
- QURGMSIQFRADOZ-UHFFFAOYSA-N
- SMILES
- C1(C2=CC(C(O)=O)=CC(C(O)=O)=C2)=CC(C(O)=O)=CC(C(O)=O)=C1
- UNSPSC Code
- 26111700 · 26111700
- NACRES
- 23 · NA.23
- Symbol(GHS)
- 9 · GHS09
- Signal word
- Warning
- Hazard statements
- 400 · H400
- Precautionary statements
- 273 · P273-P391-P501
- Hazard Codes
- N
- Risk Statements
- 50 · 50
- Safety Statements
- 61 · 61
- RIDADR
- 3077 · UN 3077
- WGK Germany
- 3 · 3
- HS Code
- 29173990 · 29173990
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 1 · Aquatic Acute 1
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H400 (97.6%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
P273, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 42 reports by companies from 3 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAquatic Acute 1 (97.6%)
Safety data
- wgk
- 3
- ridadr
- UN 3077
- hs_code
- 29173990
- risk_code
- 50
- Signal word
- Warning
- Symbol(GHS)
- GHS09
- hazard_code
- N
- safety_code
- 61
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H400
- Hazard Classifications
- Aquatic Acute 1
- Precautionary statements
- P273-P391-P501
Chemistry & industry
Applications
UsesSelected Applications of MOFs in Sustainable Energy Technologies
General DescriptionThis product has been enhanced for energy efficiency.
Upstream & downstream products
Upstream raw materials
Suppliers100 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]
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
郑州阿尔法化工有限公司+86-18530059196 · [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]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海博尼麦德新材料科技有限公司13764849732 13764849732
杭州奥得科技有限公司0571-88772972-0 15057128248 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
深圳睿迅光电材料科技有限公司0755-26718755; 15889762949 · [email protected]
上海药诚医药科技合伙企业（有限合伙）400-6181121 18616381138 · [email protected]
郑州鸿晟医药科技有限公司0371-55695890 15637198702 · [email protected]
上海弘顺生物科技有限公司15901914505 · [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]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海钰康生物科技有限公司18939844854 · [email protected]
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天津希恩思生化科技有限公司400 638 7771 · [email protected]
上海和宁美生物医药科技有限公司021-18019086215 18019086215 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
上海柏懿化工有限公司+86-21-54380268
KARMEL TECHNOLOGY (HK) CO.,LIMITED+8618795957998 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
上海笛柏生物科技有限公司400-008-9730,021-54359730 400-008-9730 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
安庆东禾生物技术有限公司15056029383 · [email protected]
上海麦克林生化科技股份有限公司15221275939 15221275939 · [email protected]
上海寰川实业有限公司021-61478794 · [email protected]
上海纳谦化学科技有限公司13598610367 13598610367 · [email protected]
河南东元化工科技有限公司16696119288 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
湖北巨胜科技有限公司027-59599241 18871490274 · [email protected]
吉林中科研伸科技有限公司0431-80534353 19917294565 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
上海皓之翔生物科技有限公司（原上海拓青化工有限公司）526763801 13301653310 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
广东翁江化学试剂有限公司0751-2815987 13927875076 · [email protected]
武汉峰耀同辉化学制品有限公司027-87466205 15377579727 · [email protected]
南京艾姆材料科技有限公司025-58063670 18795957998 · [email protected]
厦门志信化学有限公司+86-5922680277 +86-13806087780 · [email protected]
北京建强伟业科技有限公司（FUSION弗珍试剂品牌）0531-88924771 15614660963 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
北京汇科盈生物科技有限公司15210661751 · [email protected]
Related reactions
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Compound notes
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