CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C.[Cl-]
CAS: 548-62-9
Name: [4-[bis[4-(dimethylamino)phenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium chloride
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-]

Molecular Processing

Molecular formula
C25H30ClN3
Molecular weight
407.99
Exact mass
407.2128
XLogP
1.46
TPSA
9.49
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
29
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
2
Fraction Csp3
0.24
Molar refractivity
122.96

Supplementary Information

InChIKey: ZXJXZNDDNMQXFV-UHFFFAOYSA-M
Synonyms
Crystal violetgentian violet548-62-9methylrosanilinium chlorideAniline VioletHexamethyl VioletMethyl Violet 10BGentiavermMethylrosaniline chloridePyoktaninAdergonAtmonilAverminAxurisVianinViocidBadilBismuth VioletHexamethylpararosaniline chlorideBasic Violet BNGentersalGenticidGentiolettenOxycolorVermicidGenapaxOxiuranOxyozylCalcozine Violet CMeroxyl-Wander
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Involved in 8 reactions→

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