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Chemical substance record

Crystal violet

548-62-9C25H30N3.Cl407.989 g/mol
Salt and Compound WithChEBI source record

An organic chloride salt that is the monochloride salt of crystal violet cation. It has been used in creams for the topical treatment of bacterial and fungal infections, being effective against some Gram-positive bacteria (notably Staphylococcus species) and some pathogenic fungi (including Candida species) but use declined following reports of animal carcinogenicity. It has also been used for dying wood, silk, and paper, as well as a histological stain. — ChEBI

Safety references

Safety documents & references

1 indexed references
JP · NITE

Government GHS classification

R01-B-004 · FY2019

View classification

Find a product-specific SDS

Safety guides and government classification records are not a manufacturer’s SDS. Match supplier, product number, concentration, physical form, region and revision before using a document.

Identity & molecular properties

Source-linked values
CAS number548-62-9ChEBI ↗
Molecular formulaC25H30N3.ClChEBI ↗
Molar mass407.989 g/molChEBI ↗
Monoisotopic mass407.21283 DaChEBI ↗
Formal charge0ChEBI ↗
ChEBI identifierCHEBI:41688ChEBI ↗

Cross-source molecular data

PubChem
Molar mass408.0 g/molPubChem ↗
Exact mass407.2128257 DaPubChem ↗

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
crystal violet
4-{bis[4-(dimethylamino)phenyl]methylene}-N,N-dimethylcyclohexa-2,5-dien-1-iminium chloride
ZXJXZNDDNMQXFV-UHFFFAOYSA-M
CN(C)c1ccc(C(=C2C=CC(=[N+](C)C)C=C2)c2ccc(N(C)C)cc2)cc1.[Cl-]
InChI=1S/C25H30N3.ClH/c1-26(2)22-13-7-19(8-14-22)25(20-9-15-23(16-10-20)27(3)4)21-11-17-24(18-12-21)28(5)6;/h7-18H,1-6H3;1H/q+1;/p-1

Names & synonyms

4-{bis[4-(dimethylamino)phenyl]methylene}-N,N-dimethylcyclohexa-2,5-dien-1-iminium chlorideAdergonAtmonilAverminAxurisBadilchlorure de methylrosaniliniumcloruro de metilrosanilinaGentiavermMeroxylMeroxylanmethylrosanilinii chloridum

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

Classification & relationships

ChEBI ontology

Roles recorded in ChEBI

antibacterial agentanthelminthic drugantifungal agentantiseptic druganti-HIV agenthistological dyeantifungal drug

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

Safety classification · Japan

NITE / Japanese government
Japan · FY2019 source classification
[4-{Bis(4-dimethylaminophenyl)methylene}-2,5-cyclohexadien-1-ylidene]dimethylammonium chloride; C.I. Basic Violet 3; Crystal Violet · R01-B-004
EndpointReported classification
Explosives*
Flammable gases (including chemically unstable gases)*
Aerosols*
Oxidizing gases*
Gases under pressure*
Flammable liquids*

Selected source-reported endpoints. Other endpoints, rationales and conditions remain in the original classification. Missing or unlisted information does not mean non-hazardous. This is not a global classification or transport decision.

Read the original NITE classification

Mass ↔ amount of substance

Calculated from sourced mass
Equivalent amount
0.00245105 mol

Uses 407.989 g/mol from ChEBI. Assumes the substance described by this record; no purity or concentration correction is applied.

Elemental composition

Theoretical mass fractions
C
Carbon · 25 atoms
73.60%
N
Nitrogen · 3 atoms
10.30%
Cl
Chlorine · 1 atom
8.69%
H
Hydrogen · 30 atoms
7.41%

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

Research & patent references

Selected source associations

Sources & record history

Checked 27 Sep 2026
EMBL-EBI ChEBI · CHEBI:41688

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

NCBI PubChem · CID 11057 · 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.