25,26,27,28-Tetrahydroxycalix[4]arene
Properties
- Molecular formula
- C28H24O4
- Molar mass
- 424.50 g/mol
- Exact mass
- 424.1675 Da
- Melting point
- 313 °C
- logP
- 5.19Crippen estimate
- Polar surface area
- 80.9 Ų
- H-bond donors / acceptors
- 4 / 4
- Rotatable bonds
- 0
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation97.8% of notifiers
Aggregated from 45 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
74568-07-3SMILES
Oc1c2cccc1Cc1cccc(c1O)Cc1cccc(c1O)Cc1cccc(c1O)C2InChIKey
YPNHVQZZPXPQOS-UHFFFAOYSA-NInChI
InChI=1S/C28H24O4/c29-25-17-5-1-6-18(25)14-20-8-3-10-22(27(20)31)16-24-12-4-11-23(28(24)32)15-21-9-2-7-19(13-17)26(21)30/h1-12,29-32H,13-16H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
8 names
- Pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene-25,26,27,28-tetrol
- Calix[4]arene-25,26,27,28-tetrol
- Calix[4]arenetetrol
- Calix[4]arene
- Pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene-5,25,26,27-tetrol
- CALX 4
- Pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene-5,17,25,27-tetrol
- 25,26,27,28-Tetrahydroxycalix(4)arene
Work with 25,26,27,28-Tetrahydroxycalix[4]arene
Similar compounds
Bicyclo(4.1.0)hepta-1,3,5-triene4646-69-950 % similar
9,10-Dihydroanthracene613-31-050 % similar
4H-Cyclopenta[def]phenanthrene203-64-543 % similar
Fluorene86-73-743 % similar
Pyrogallol87-66-143 % similar
Dithranol1143-38-041 % similar
2,6-Dibromophenol608-33-341 % similar
2,6-Dichlorophenol87-65-041 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.