Basic information
- CAS
790-83-0- Standard SMILES
O=C(O)c1ccc(Cc2ccc(C(=O)O)cc2)cc1- InChIKey
VTDMBRAUHKUOON-UHFFFAOYSA-N- Molecular formula
- C15H12O4
- Average molar mass
- 256.25 g/mol
- Monoisotopic mass
- 256.07355886
Names & identifiers
- Preferred name
- Diphenylmethane-4,4'-dicarboxylic acid
- IUPAC
- 4-[(4-carboxyphenyl)methyl]benzoic acid
- English name
- DIPHENYLMETHANE-4,4'-DICARBOXYLIC ACID
- Molecular formula
- C15H12O4
- Molecular weight
- 256.25
Names & synonyms
Diphenylmethane-4,4'-dicarboxylic acidRefChem:588920674-232-1790-83-04,4'-methylenedibenzoic acid4-[(4-carboxyphenyl)methyl]benzoic acidMFCD00060322p,p'-Methylenedibenzoic acidSCHEMBL68390DTXSID30310785AKOS025309996BS-48967
Show more names
Bis(p-carboxyphenyl)methaneBis(4-carboxyphenyl)methaneBenzoic acid, 4,4'-Methylenebis-Diphenylmethan-4,4'-dicarboxylic acid
E75811Diphenylmethane-4,4 inverted exclamation marka-dicarboxylic acidDIPHENYLMETHANE-4,4-DICARBOXYLICACIDFT-0676246A839577orb3213631SCHEMBL8580744Benzoicacid,4,4'-methylenebis-
Database identifiers
- CAS
790-83-0- PubChem CID
- 314352
- DTXSID
DTXSID30310785- EC Number
- 674-232-1
- Nikkaji
- J802.809E
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 291
Physicochemical properties
- Melting point
- 346 °C · 346 °C
- Boiling point
- 485.2 · 485.2±38.0 °C(Predicted)
- Density
- 1.321 · 1.321
- storage temp.
- Sealed in dry,Room Temperature
- pka
- 3.95 · 3.95±0.10(Predicted)
- Appearance
- Off-white to light brown Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36/37/39
- HazardClass
- IRRITANT
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36/37/39
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Applications
UsesDiphenylmethane-4,4'-dicarboxylic acid is used in the preparation of methylenedibenzoate zinc coordination polymers with luminescence properties.
Upstream & downstream products
Upstream raw materials
Suppliers44 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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