Dibutyl squarate
Properties
- Molecular formula
- C12H18O4
- Molar mass
- 226.27 g/mol
- Exact mass
- 226.1205 Da
- Boiling point
- 139 °C (at 0.5 Torr)
- logP
- 1.64Crippen estimate
- Polar surface area
- 52.6 Ų
- H-bond donors / acceptors
- 0 / 4
- Rotatable bonds
- 8
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H317 May cause an allergic skin reaction91.3% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation87% of notifiers
Aggregated from 46 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P272, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
2892-62-8SMILES
CCCCOc1c(OCCCC)c(=O)c1=OInChIKey
XBRWELTXMQSEIN-UHFFFAOYSA-NInChI
InChI=1S/C12H18O4/c1-3-5-7-15-11-9(13)10(14)12(11)16-8-6-4-2/h3-8H2,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
11 names
- 3-Cyclobutene-1,2-dione, 3,4-dibutoxy-
- Cyclobutenedione, dibutoxy-
- 3,4-Dibutoxy-3-cyclobutene-1,2-dione
- 1,2-Dibutoxy-1-cyclobutene-3,4-dione
- 1,2-Dibutoxycyclobutene-3,4-dione
- Squaric acid dibutyl ether
- Dibutylquadratate
- Squaric acid dibutyl ester
- 3,4-Dibutoxycyclobut-3-ene-1,2-dione
- NSC 113489
- Dibutoxy-3-cyclobutene-1,2-dione
Work with Dibutyl squarate
Similar compounds
Diethyl squarate5231-87-858 % similar
9,10-Dibutoxyanthracene76275-14-452 % similar
Butyl phenyl ether1126-79-043 % similar
Dibutyl ether142-96-142 % similar
Glycol dibutyl ether112-48-140 % similar
Diethylene glycol dibutyl ether112-73-240 % similar
5,8,11,14,17-Pentaoxaheneicosane112-98-140 % similar
4-Butoxybenzaldehyde5736-88-940 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds