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Basic Violet 2

CAT: 0127-OR1028643-01Size: 5 gDry Ice: NoHazardous: No
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CAT#:0127-OR1028643-01Size:5 g
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CAS Number
3248-91-7
Synonyms
4-[ (4-amino-3-methylphenyl) - (4-imino-3-methylcyclohexa-2,5-dien-1-ylidene) methyl]-2-methylaniline; hydrochloride
Purity
BS
Smiles
CC1=CC(=C(C2=CC(=C(C=C2)N)C)C3=CC(=C(C=C3)N)C)C=CC1=N.Cl

Chemical Information

New Fuchsin

New fuchsin is a hydrochloride that is the monohydrochloride of 4-[(4-aminophenyl)(4-iminocyclohexa-2,5-dien-1-ylidene)methyl]-2-methylaniline. One of the minor constituents of Basic fuchsin, together with pararosanilin, rosanilin and magenta II. It has a role as a fluorochrome and a histological dye. It contains a new fuchsin(1+).

CAS Number3248-91-7
PubChem CID14454445
IUPAC Name4-[(4-amino-3-methylphenyl)-(4-imino-3-methylcyclohexa-2,5-dien-1-ylidene)methyl]-2-methylaniline;hydrochloride
Molecular FormulaC22H24ClN3
Molecular Weight365.9
Topological Polar Surface Area75.9
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count26
Formal Charge0
Complexity585
SMILES
CC1=CC(=C(C2=CC(=C(C=C2)N)C)C3=CC(=C(C=C3)N)C)C=CC1=N.Cl
InChI
InChI=1S/C22H23N3.ClH/c1-13-10-16(4-7-19(13)23)22(17-5-8-20(24)14(2)11-17)18-6-9-21(25)15(3)12-18;/h4-12,23H,24-25H2,1-3H3;1H
InChIKey
IPSIPYMEZZPCPY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of New Fuchsin
CAS: 3248-91-7
CID: 14454445
Formula: C22H24ClN3
MW: 365.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight365.9
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass365.1658755
Monoisotopic Mass365.1658755
Topological Polar Surface Area75.9 Ų
Heavy Atom Count26
Formal Charge0
Complexity585
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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