Basic information
- CAS
814-16-4- Standard SMILES
CCOP(=O)(CC(=O)C(C)(C)C)OCC- InChIKey
LOUZJUCIRJMGHZ-UHFFFAOYSA-N- Molecular formula
- C10H21O4P
- Average molar mass
- 236.24 g/mol
- Monoisotopic mass
- 236.11774614
Names & identifiers
- Preferred name
- Diethyl (3,3-dimethyl-2-oxobutyl)phosphonate
- IUPAC
- 1-diethoxyphosphoryl-3,3-dimethylbutan-2-one
- English name
- diethyl (3,3-dimethyl-2-oxobutyl)phosphonate
- Molecular formula
- C10H21O4P
- Molecular weight
- 236.25
Names & synonyms
Diethyl (3,3-dimethyl-2-oxobutyl)phosphonate814-16-4EINECS 212-393-8DTXSID40231078RefChem:587013DTXCID40153569212-393-8SCHEMBL12446811LOUZJUCIRJMGHZ-UHFFFAOYSA-NAKOS004907025SY511574NS00038122
Show more names
1-diethoxyphosphoryl-3,3-dimethylbutan-2-one(3,3-Dimethyl-2-oxobutyl)phosphonic acid diethyl ester(2-Oxo-3,3-dimethylbutyl)phosphonic acid diethyl esterPhosphonic acid, P-(3,3-dimethyl-2-oxobutyl)-, diethyl ester
Database identifiers
- CAS
814-16-4- PubChem CID
- 69942
- DTXSID
DTXSID40231078- EC Number
- 212-393-8
- Nikkaji
- J193.196B
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 245
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H335-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H335-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers2 total
湖北玖天生物医药科技有限公司027-88013699 17354350817 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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