1,2-Propanediol, 3-(dimethylamino)-


Chemical Name: 1,2-Propanediol, 3-(dimethylamino)-
CAS Number: 623-57-4
Product Number: AG003JD7(AGN-PC-0JLRRX)
Synonyms:
MDL No:
Molecular Formula: C5H13NO2
Molecular Weight: 119.1622

Identification/Properties


Properties
BP:
216-217°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.4609(lit.)
Computed Properties
Molecular Weight:
119.164g/mol
XLogP3:
-1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
119.095g/mol
Monoisotopic Mass:
119.095g/mol
Topological Polar Surface Area:
43.7A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
56.4
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
3267
Hazard Statements:
H314
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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Chemical Structure



The compound 3-(Dimethylamino)-1,2-propanediol plays a crucial role in chemical synthesis as a versatile building block. It is commonly utilized as a key intermediate in the production of various pharmaceuticals and agrochemicals due to its unique chemical structure and reactivity. Its primary function lies in facilitating the formation of complex molecular structures through processes such as acylation, alkylation, and condensation reactions. Additionally, 3-(Dimethylamino)-1,2-propanediol serves as a valuable catalyst in asymmetric synthesis, enabling the creation of chiral molecules with high enantiomeric purity. Its compatibility with a wide range of functional groups and its ability to participate in numerous synthetic transformations make it an indispensable component in the toolkit of organic chemists.