Basic information
- CAS
27476-27-3- Standard SMILES
Cc1ccccc1C(=O)[O-].Cc1ccccc1C(=O)[O-].[Cd+2]- InChIKey
CTBIYKCSLJGMRW-UHFFFAOYSA-L- Molecular formula
- C16H14CdO4
- Average molar mass
- 382.69 g/mol
- Monoisotopic mass
- 383.992574
Names & identifiers
- Preferred name
- Benzoic acid, 2-methyl-, cadmium salt
- IUPAC
- cadmium(2+);bis(2-methylbenzoate)
- English name
- cadmium toluate
- Molecular formula
- C16H14CdO4
- Molecular weight
- 382.69096
Names & synonyms
Benzoic acid, 2-methyl-, cadmium salt52337-78-7Cadmium toluateCadmium o-toluatecadmium bis(2-methylbenzoate)Cadmium 2-methylbenzoateEINECS 257-860-7Cadmium methylbenzoateBenzoic acid, 2-methyl-, cadmium salt (2:1)SCHEMBL6916340DTXSID0068739CTBIYKCSLJGMRW-UHFFFAOYSA-L
Show more names
Toluic acid cadmium salt
EINECS 248-480-2Benzoic acid, methyl-, cadmium salt27476-27-3Benzoic acid, methyl-, cadmium salt (2:1)NS00087372
Database identifiers
- CAS
27476-27-3、52337-78-7- PubChem CID
- 104161
- DTXSID
DTXSID0068739- EC Number
- 248-480-2、257-860-7
- Nikkaji
- J162.870D
Properties
Computed structural properties
- Topological polar surface area
- 80.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 126
Physicochemical properties
- REACH Annex XVII Substances List
- Cadmium toluate (27476-27-3)
- EPA Substance Registry System
- Benzoic acid, methyl-, cadmium salt (27476-27-3)
- TSCA
- TSCA listed
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
Danger
H301: Toxic if swallowed [Danger Acute toxicity, oral]
P203, P260, P264, P270, P271, P280, P284, P301+P316, P302+P352, P304+P340, P316, P317, P318, P319, P320, P321, P330, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Hazard information
Regulatory Information
Chemical: Benzoic acid, 2-methyl-, cadmium salt
Restricted substance: Cadmium o-toluate
Restricted substance: Cadmium toluate
Other Safety InformationIMAP assessments - Benzoic acid, 2-methyl-, cadmium salt: Human health tier II assessment
Hazard Classes and CategoriesCarcinogenicity - category 1B
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information
Benzoic acid, methyl-, cadmium salt (2:1): INACTIVE
Benzoic acid, 2-methyl-, cadmium salt (2:1): INACTIVE
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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