3-(Dimethylamino)-1,2-propanediol - CAS 623-57-4
Catalog: |
BB031549 |
Product Name: |
3-(Dimethylamino)-1,2-propanediol |
CAS: |
623-57-4 |
Synonyms: |
3-(dimethylamino)propane-1,2-diol |
IUPAC Name: | 3-(dimethylamino)propane-1,2-diol |
Description: | 3-(Dimethylamino)-1,2-propanediol (CAS# 623-57-4) is a reagent in the synthesis of 1,2-Dioleoyl-3-trimethylammonium-propane, Chloride (D484450). |
Molecular Weight: | 119.16 |
Molecular Formula: | C5H13NO2 |
Canonical SMILES: | CN(C)CC(CO)O |
InChI: | InChI=1S/C5H13NO2/c1-6(2)3-5(8)4-7/h5,7-8H,3-4H2,1-2H3 |
InChI Key: | QCMHUGYTOGXZIW-UHFFFAOYSA-N |
Boiling Point: | 216-217 °C |
Density: | 1.004 g/cm3 |
MDL: | MFCD00004714 |
LogP: | -1.09880 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501 |
Signal Word: | Danger |
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Complexity: | 56.4 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 119.094628657 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 119.094628657 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 43.7 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -1 |
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