DL-Panthenol - CAS 16485-10-2
Catalog: |
BB012144 |
Product Name: |
DL-Panthenol |
CAS: |
16485-10-2 |
Synonyms: |
2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide |
IUPAC Name: | 2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide |
Description: | DL-Panthenol is uesd to synthetize organic compound. |
Molecular Weight: | 205.25 |
Molecular Formula: | C9H19NO4 |
Canonical SMILES: | CC(C)(CO)C(C(=O)NCCCO)O |
InChI: | InChI=1S/C9H19NO4/c1-9(2,6-12)7(13)8(14)10-4-3-5-11/h7,11-13H,3-6H2,1-2H3,(H,10,14) |
InChI Key: | SNPLKNRPJHDVJA-UHFFFAOYSA-N |
Boiling Point: | 118-120 °C | Condition: Press: 0.02 Torr |
Melting Point: | 60-61 °C | Condition: Solv: ethyl acetate |
Flash Point: | 246.3°C |
Density: | 1.166±0.06 g/cm3 |
Solubility: | Soluble in water, ethanol, ether, chloroform, and propylene glycol. |
Appearance: | Solid powder |
Storage: | Store in a cool and dry place and at 0 - 4 °C for short term (days to weeks) or -55 °C for long term (months to years). |
MDL: | MFCD00002944 |
LogP: | -0.74470 |
Refractive Index: | 1.501 |
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PMID | Publication Date | Title | Journal |
28503966 | 20171201 | Topical use of dexpanthenol: a 70th anniversary article | The Journal of dermatological treatment |
22890527 | 20120701 | Nasal obstruction as a key symptom in allergic rhinitis: efficacy and safety of a medical device in children | Otolaryngologia polska = The Polish otolaryngology |
22546378 | 20120501 | Effects of intravesical dexpanthenol use on lipid peroxidation and bladder histology in a chemical cystitis animal model | Urology |
22320671 | 20120301 | Allergic contact dermatitis caused by dexpanthenol: report of two cases | Contact dermatitis |
22395588 | 20120301 | Comparative trial of 5% dexpanthenol in water-in-oil formulation with 1% hydrocortisone ointment in the treatment of childhood atopic dermatitis: a pilot study | Journal of drugs in dermatology : JDD |
Complexity: | 182 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 205.13140809 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 4 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 205.13140809 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 89.8 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.9 |
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