Crystal Violet lactone
Properties
- Molecular formula
- C26H29N3O2
- Molar mass
- 415.54 g/mol
- Exact mass
- 415.2260 Da
- Melting point
- 176–179 °C
- Water solubility
- < 1 g/L (22.5 °C)
- logP
- 4.35Crippen estimate
- Polar surface area
- 36.0 Ų
- H-bond donors / acceptors
- 0 / 5
- Rotatable bonds
- 5
Hazards
Warning
- H315 Causes skin irritation45% of notifiers
- H319 Causes serious eye irritation45% of notifiers
- H335 May cause respiratory irritation44.1% of notifiers
Aggregated from 222 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
1552-42-7SMILES
CN(C)c1ccc(C2(c3ccc(N(C)C)cc3)OC(=O)c3cc(N(C)C)ccc32)cc1InChIKey
IPAJDLMMTVZVPP-UHFFFAOYSA-NInChI
InChI=1S/C26H29N3O2/c1-27(2)20-11-7-18(8-12-20)26(19-9-13-21(14-10-19)28(3)4)24-16-15-22(29(5)6)17-23(24)25(30)31-26/h7-17H,1-6H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
17 names · show all
- 1(3H)-Isobenzofuranone, 6-(dimethylamino)-3,3-bis[4-(dimethylamino)phenyl]-
- Phthalide, 6-(dimethylamino)-3,3-bis[p-(dimethylamino)phenyl]-
- 6-(Dimethylamino)-3,3-bis[4-(dimethylamino)phenyl]-1(3H)-isobenzofuranone
- 3,3-Bis[p-(dimethylamino)phenyl]-6-(dimethylamino)phthalide
- 3,3-Bis[4-(dimethylamino)phenyl]-6-(dimethylamino)phthalide
- 3,3-Bis[4-(dimethylamino)phenyl]-6-(dimethylamino)-1,3-dihydroisobenzofuran-1-one
- Copikem I
- Pergascript blue I 2R
- CVL
- Color former CVL
- NSC 32991
- NSC 3562
- Copikem 1 blue
- 6-Dimethylamino-3,3-bis(4-dimethylaminophenyl)-3H-isobenzofuran-1-one
- CVL-K
- Chameleon blue 3
- LCV-L
Work with Crystal Violet lactone
Similar compounds
Phenolphthalein77-09-846 % similar
O-Cresolphthalein596-27-042 % similar
Solvent red 49509-34-242 % similar
3′,6′-Dichlorospiro[isobenzofuran-1(3H),9′-[9H]xanthen]-3-one630-88-641 % similar
Poly(ethylene glycol) bis(p-dimethylaminobenzoate)71512-90-841 % similar
Phenolphthalein diphosphate2090-82-640 % similar
Ethyl 4-(dimethylamino)benzoate10287-53-339 % similar
Tetrabromophenolphthalein76-62-038 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.