Basic information
- CAS
83877-91-2- Standard SMILES
CC(C)C[O-].CC(C)C[O-].CCOC(=O)/C=C(/C)[O-].CCOC(=O)/C=C(/C)[O-].[Ti+4]- InChIKey
DVPALPRNLJYGKK-NRFIWDAESA-L- Molecular formula
- C20H36O8Ti
- Average molar mass
- 452.4 g/mol
- Monoisotopic mass
- 452.1889588
Names & identifiers
- Preferred name
- Titanium, bis(ethyl 3-oxobutanoato-kappaO1',kappaO3)bis(2-methyl-1-propanolato)-
- IUPAC
- bis((Z)-4-ethoxy-4-oxobut-2-en-2-olate);bis(2-methylpropan-1-olate);titanium(4+)
- English name
- Diisobutoxy-bisethylacetoacetatotitanate
- Molecular formula
- C20H36O8Ti
- Molecular weight
- 452.37
Names & synonyms
EINECS 281-161-6Bis(ethyl acetoacetato-O1',O3)bis(2-methylpropan-1-olato)titaniumEC 281-161-6Titanium, bis(ethyl 3-oxobutanoato-O1',O3)bis(2-methyl-1-propanolato)-Titanium, bis(ethyl 3-oxobutanoato-kappaO1',kappaO3)bis(2-methyl-1-propanolato)-RefChem:898440Titanium, bis(ethyl 3-oxobutanoato-.kappa.O1',.kappa.O3)bis(2-methyl-1-propanolato)-281-161-6DVPALPRNLJYGKK-NRFIWDAESA-LHY- 1808TYZOR IBAYDiisobutoxy-bisethylacetoacetatotitate
Show more names
DIISOBUTOXY-BISETHYLACETOACETATOTITANATEdiisobutoxy-bisethylacetoacetatotitanate-tyzoribayTIANFU-CHEM_Diisobutoxy-bisethylacetoacetatotitanatebis(ethyl acetoacetato)bis(2-methylpropan-1-olato)titaniumbis(ethyl3-oxobutanoato-o1’,o3)bis(2-methyl-1-propanolato)-titaniubis(ethyl3-oxobutanoato-O1’,O3)bis(2-methyl-1-propanolato)-Titanium
Properties
Computed structural properties
- Topological polar surface area
- 145 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 144
Experimental & physicochemical properties
Physical DescriptionCBI
Physicochemical properties
- Melting point
- -76 °C · -76.00°C
- Boiling point
- 108 ℃[at · 108℃[at 101 325 Pa]
- Density
- 1.08 · 1.08[at 20℃]
- vapor pressure
- 10 hPa · 10hPa at 20.9℃
- Flash point
- 42 °C · 42.00°C
- Water Solubility
- 85 g/L · 85g/L at 20℃
- LogP
- 0.76 at · 0.76 at 25℃
- EPA Substance Registry System
- Titanium, bis(ethyl 3-oxobutanoato-O1',O3)bis(2-methyl-1-propanolato)- (83877-91-2)
- Symbol(GHS)
- 7 · GHS07,GHS02,GHS05
- Signal word
- Danger
- Hazard statements
- 226 · H226-H318-H336-H335-H315
- Precautionary statements
- 280 · P280-P305+P351+P338-P310-P261-P271-P304+P340-P312-P403+P233-P405-P501-P264-P280-P302+P352-P321-P332+P313-P362
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 180 reports by companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: Titanium, bis(ethyl 3-oxobutanoato-O1',O3)bis(2-methyl-1-propanolato)-
Titanium, bis(ethyl 3-oxobutanoato-.kappa.O1',.kappa.O3)bis(2-methyl-1-propanolato)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Titanium, bis(ethyl 3-oxobutanoato-.kappa.O1',.kappa.O3)bis(2-methyl-1-propanolato)- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
REACH registered substance: Bis(ethyl acetoacetato-O1',O3)bis(2-methylpropan-1-olato)titanium (EC: 281-161-6)
Titanium, bis(ethyl 3-oxobutanoato-O1',O3)bis(2-methyl-1-propanolato)-: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
Safety data
- tsca
- TSCA listed
- ridadr
- 1993
- risk_code
- 10
- Signal word
Chemistry & industry
Uses & manufacturing
U.S. Production2023: 50,000 - <250,000 lb
Consumer UsesAdhesion/cohesion promoter
Industry UsesAdhesion/cohesion promoter
General Manufacturing Information
Adhesive Manufacturing
Titanium, bis(ethyl 3-oxobutanoato-.kappa.O1',.kappa.O3)bis(2-methyl-1-propanolato)-: ACTIVE
Suppliers31 total
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
孝感深远化工有限公司15527621225; 15527621225 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13376591640 · [email protected]
武汉卡诺斯科技有限公司153-37111468 15337111468 · [email protected]
上海丽康新材料有限公司+86-16631818819 +86-17736933208 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…