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Chemical substance record

Calcium carbonate

471-34-1CO3.Ca100.086 g/mol
Salt and Compound WithChEBI source record

A calcium salt with formula CCaO3. — ChEBI

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Identity & molecular properties

Source-linked values
CAS number471-34-1ChEBI ↗
Molecular formulaCO3.CaChEBI ↗
Molar mass100.086 g/molChEBI ↗
Monoisotopic mass99.94733 DaChEBI ↗
Formal charge0ChEBI ↗
ChEBI identifierCHEBI:3311ChEBI ↗

Cross-source molecular data

PubChem
Molar mass100.09 g/molPubChem ↗
Exact mass99.9473347 DaPubChem ↗
Topological polar surface area (Ų)63.2PubChem ↗
H-bond donors0PubChem ↗
H-bond acceptors3PubChem ↗
Rotatable bonds0PubChem ↗

PubChem computed values are shown separately from the ChEBI record. An exact InChIKey match was used to connect the records. Molecular descriptors do not describe a supplied product’s purity, particle size or performance.

Names & structural identifiers

Copy any identifier
calcium carbonate
calcium carbonate
VTYYLEPIZMXCLO-UHFFFAOYSA-L
O=C([O-])[O-].[Ca+2]
InChI=1S/CH2O3.Ca/c2-1(3)4;/h(H2,2,3,4);/q;+2/p-2

Names & synonyms

calcium trioxidocarbonate

Names are supplied by ChEBI. Trade names and related synonyms may describe a broader product context.

Classification & relationships

ChEBI ontology

Roles recorded in ChEBI

geroprotectorfertilizerhypoglycemic agentantineoplastic agentanti-arrhythmia drugbone density conservation agenthepatoprotective agentanti-HIV agentantacidanti-obesity agent

Database role annotations describe reported biological or chemical roles; they are not product approvals or recommendations for use.

Mass ↔ amount of substance

Calculated from sourced mass
Equivalent amount
0.00999141 mol

Uses 100.086 g/mol from ChEBI. Assumes the substance described by this record; no purity or concentration correction is applied.

Elemental composition

Theoretical mass fractions
O
Oxygen · 3 atoms
47.95%
Ca
Calcium · 1 atom
40.04%
C
Carbon · 1 atom
12.00%

Calculated theoretical mass fractions from the reported formula and PubChem periodic-table atomic masses. These are not assay or purity results.

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Sources & record history

Checked 27 Sep 2026
EMBL-EBI ChEBI · CHEBI:3311

Release 255, 9 September 2026. ChEBI three-star (manually annotated) source entry. View original record ↗ · CC BY 4.0

NCBI PubChem · CID 10112 · retrieved 2026-09-27

PubCAS formats source data, connects references and computes explicitly labelled conversions. CAS cross-references are supplied by ChEBI; they do not constitute CAS verification or endorsement.