Basic information
- CAS
22322-28-7- Standard SMILES
O=C([O-])CCCCC(=O)[O-].[Ca+2]- InChIKey
KTAAUBVMSAZOLC-UHFFFAOYSA-L- Molecular formula
- C6H8CaO4
- Average molar mass
- 184.2 g/mol
- Monoisotopic mass
- 184.0048496
Names & identifiers
- Preferred name
- Adipic acid, calcium salt
- IUPAC
- calcium hexanedioate
- English name
- Calcium adipate
- Molecular weight
- 0
Names & synonyms
Adipic acid, calcium saltRefChem:573368Calcium adipate7486-40-0calcium;hexanedioateAdipinsaeure, calciumsalzEINECS 231-295-601L9Y9D98WCalcium adipatAdipic acid calcium saltcalciumadipatHexanedioic acid, calcium salt
Show more names
UNII-01L9Y9D98W22322-28-7SCHEMBL587111SKL437KTAAUBVMSAZOLC-UHFFFAOYSA-LADIPIC ACID, CALCIUM SALT (1:1)DB-318888NS00082123
Database identifiers
- CAS
22322-28-7、7486-40-0- PubChem CID
- 185482
- DTXSID
DTXSID00944970- UNII
- 01L9Y9D98W
- EC Number
- 231-295-6
- Nikkaji
- J125.427H
Properties
Computed structural properties
- Topological polar surface area
- 80.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 103
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
This chemical does not meet GHS hazard criteria for 100% (2 of 2) of all reports.
Not Classified
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesNot Classified
Chemistry & industry
Uses & manufacturing
Use ClassificationFood Additives -> FOOD_ADDITIVE -> JECFA Functional Classes
Suppliers2 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
杭州施特安化工有限公司+86-571-86108208 17681825664 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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