Basic information
- CAS
6626-36-4- Standard SMILES
C=CCOCC(O)CNCC(O)COCC=C- InChIKey
FOLUGAPHACONGE-UHFFFAOYSA-N- Molecular formula
- C12H23NO4
- Average molar mass
- 245.32 g/mol
- Monoisotopic mass
- 245.16270821
Names & identifiers
- Preferred name
- 2-Propanol, 1,1'-iminobis(3-allyloxy-
- IUPAC
- 1-[(2-hydroxy-3-prop-2-enoxypropyl)amino]-3-prop-2-enoxypropan-2-ol
- English name
- (3,3'-Diallyloxy-2,2'-dihydroxy)dipropylamine
- Molecular formula
- C12H23NO4
- Molecular weight
- 245.32
Names & synonyms
6626-36-42-Propanol, 1,1'-iminobis(3-allyloxy-NSC 59857BRN 17899541,1'-Iminobis(3-(allyloxy))-2-propanol2-Propanol, 1,1'-iminobis(3-(2-propenyloxy)-4-04-00-01870 (Beilstein Handbook Reference)1,1'-Iminobis[3-(allyloxy)]-2-propanolRefChem:2655552-Propanol, 1,1'-iminobis(3-(2-propenyloxy)-(9CI)NSC598571-Allyloxy-3-(3-allyloxy-2-hydroxy-propylamino)-propan-2-ol
Show more names
1,1'-Iminobis[3-(2-propenyloxy)-2-propanol]2-Propanol, 1,1'-iminobis[3-(2-propen-1-yloxy)-
bis[2-hydroxy-3-(prop-2-en-1-yloxy)propyl]amine1-(allyloxy)-3-{[3-(allyloxy)-2-hydroxypropyl]amino}propan-2-ol1-allyloxy-3-[(3-allyloxy-2-hydroxy-propyl)amino]propan-2-ol1-(Allyloxy)-3-{[3-(allyloxy)-2-hydroxypropyl]-amino}propan-2-ol(3,3'-DIALLYLOXY-2,2'-DIHYDROXY)DIPROPYLAMINESCHEMBL2400387DTXSID609847761-[(2-hydroxy-3-prop-2-enoxypropyl)amino]-3-prop-2-enoxypropan-2-ol
Database identifiers
- CAS
6626-36-4- PubChem CID
- 96205
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 71 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 12
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 179
Physicochemical properties
- Boiling point
- 368.8 · 368.8±42.0 °C(Predicted)
- Density
- 1.047 · 1.047±0.06 g/cm3(Predicted)
- pka
- 13.78 · 13.78±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Suppliers1 total
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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