Basic information
- CAS
194204-51-8- Standard SMILES
CCC(=O)OCOC(COCc1ccccc1)COC(=O)CC- InChIKey
VTLHBYSIWPFXJM-UHFFFAOYSA-N- Molecular formula
- C17H24O6
- Average molar mass
- 324.4 g/mol
- Monoisotopic mass
- 324.15728849
Names & identifiers
- Preferred name
- 1-Propanol,2-[(1-oxopropoxy)methoxy]-3-(phenylmethoxy)-,propanoate
- IUPAC
- [3-phenylmethoxy-2-(propanoyloxymethoxy)propyl] propanoate
- English name
- Diproprionate
- Molecular formula
- C17H24O6
- Molecular weight
- 324.37
Names & synonyms
194204-51-81-Propanol,2-[(1-oxopropoxy)methoxy]-3-(phenylmethoxy)-,propanoate1-PROPANOL,2-((1-OXOPROPOXY)METHOXY)-3-(PHENYLMETHOXY)-,PROPANOATERefChem:436276620-538-53-(Benzyloxy)-2-((propionyloxy)methoxy)propyl propionate[3-phenylmethoxy-2-(propanoyloxymethoxy)propyl] propanoateSCHEMBL6378681VTLHBYSIWPFXJM-UHFFFAOYSA-NDTXSID301384777CS-00138961-benzyloxy-3-propionyloxy-2-(propionyloxy)methoxy propane
Show more names
Diproprionate1-Propanol, 2-[(1-oxopropoxy)methoxy]-3-(phenylmethoxy)-, 1-propanoate
Database identifiers
- CAS
194204-51-8- PubChem CID
- 9862041
- DTXSID
DTXSID301384777- EC Number
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 13
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 338
Physicochemical properties
- Boiling point
- 415.4 · 415.4±45.0 °C(Predicted)
- Density
- 1.115 · 1.115±0.06 g/cm3(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H335
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P
Safety & regulation
GHS classification
GHS Classification
Warning
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P261, P264+P265, P271, P280, P304+P340, P305+P351+P338, P319, P337+P317, 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 CategoriesEye Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H335
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers10 total
常州市华阳科技有限公司+8615250961469 · [email protected]
泰州市众致生物科技有限公司[email protected] 15066129350 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
海蔚化学86-21-51086038 · [email protected]
爆牛贸易重庆有限公司+86-023-6139-8061 +86-86-13650506873 · [email protected]
SUZHOU SENFEIDA CHEMICAL CO.,LTD+86-0512-83500002 +86-15195660023 · [email protected]
河南科弘生物科技有限公司0371-55969461 19139748274 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418684 +86-18949823763 · [email protected]
CD Chemical Group Limited+86-13651442114 · [email protected]
Related reactions
5 records
Compound notes
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