Basic information
- CAS
65611-33-8- Standard SMILES
CCCCCCCCCCOC(=O)C(Cl)(Cl)Cl- InChIKey
JVOWHDCGJSEUMO-UHFFFAOYSA-N- Molecular formula
- C12H21Cl3O2
- Average molar mass
- 303.6 g/mol
- Monoisotopic mass
- 302.060713
Names & identifiers
- Preferred name
- Decyl trichloroacetate
- IUPAC
- decyl 2,2,2-trichloroacetate
- English name
- Trichloroacetic acid decyl ester (C10)
- Molecular formula
- C12H21Cl3O2
- Molecular weight
- 303.65
Names & synonyms
Decyl trichloroacetate65611-33-8Trichloroacetic acid, decyl estern-decyltrichloroacetateDecyl trichloroacetate #SCHEMBL6642347SCHEMBL6642350DTXSID40334871JVOWHDCGJSEUMO-UHFFFAOYSA-NAcetic acid, trichloro-, n-decyl estern-decyl trichloroacetate1-DECANYL, TRICHLORO ACETATE ESTER
Show more names
trichloroaceticaciddecylester(c10)Aceticacid,trichloro-,n-decylesterAcetic acid, 2,2,2-trichloro-, decyl ester
Database identifiers
- CAS
65611-33-8- PubChem CID
- 522176
- DTXSID
DTXSID40334871- EC Number
- 633-156-9
- Nikkaji
- J2.350.255K
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 10
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 202
Experimental & physicochemical properties
SpringerMaterials PropertiesNuclear quadrupole resonance spectroscopy
Physicochemical properties
- Boiling point
- 158 · 158-160 °C(Press: 10 Torr)
- Density
- 1.1234 g/cm3 · 1.1234 g/cm3
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H319-H315
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H319-H315
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Suppliers1 total
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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