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Crystal Violet C.I. No. 42555

CAT: 0286-C26930-01Size: 100 gDry Ice: NoHazardous: No
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CAT#:0286-C26930-01Size:100 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
548-62-9
Synonyms
Basic Violet 3; Brilliant Violet; Gentian Violet; Hexamethylpararosaniline chloride; Methyl Violet 10B
Pictogram
07 - Irritant; 08 - Health Hazard; 09 - Environmental hazard
UDF Signal Word
Warning
MDL Number
MFCD00011750
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation; H351 Suspected of causing cancer; H410 Very toxic to aquatic life with long-lasting effects.
DOT Name
Not D.O.T.-Regulated
Precautions
P261 Avoid breathing dust/fume/gas/mist/vapors/spray; P273 Avoid release to the environment; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P308+P313 IF exposed or concerned: Get medical advice/attention; P332+P313 IF SKIN irritation occurs: Get medical advice/attention.

Chemical Information

Crystal Violet

Gentian Violet can cause cancer according to an independent committee of scientific and health experts.

CAS Number548-62-9
PubChem CID11057
IUPAC Name[4-[bis[4-(dimethylamino)phenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium chloride
Molecular FormulaC25H30ClN3
Molecular Weight408.0
Topological Polar Surface Area9.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count29
Formal Charge0
Complexity542
SMILES
CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C.[Cl-]
InChI
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
InChIKey
ZXJXZNDDNMQXFV-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Crystal Violet
CAS: 548-62-9
CID: 11057
Formula: C25H30ClN3
MW: 408.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight408.0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass407.2128257
Monoisotopic Mass407.2128257
Topological Polar Surface Area9.5 Ų
Heavy Atom Count29
Formal Charge0
Complexity542
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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