3-Dimethylamino-2,2-dimethyl-1-propanol

Base Information

• Chemical Name: 3-Dimethylamino-2,2-dimethyl-1-propanol
• CAS No.: 19059-68-8
• Deprecated CAS: 1416163-41-1
• Molecular Formula: C7H17 N O
• Molecular Weight: 131.218
• Hs Code.: 2922190090
• European Community (EC) Number: 242-791-7
• NSC Number: 403920
• UNII: 6Z86J68AVL
• DSSTox Substance ID: DTXSID0066452
• Nikkaji Number: J149.482A
• Wikidata: Q81993034
• Mol file: 19059-68-8.mol

Synonyms:3-Dimethylamino-2,2-dimethyl-1-propanol;19059-68-8;3-(Dimethylamino)-2,2-dimethylpropan-1-ol;Dimethylaminoneopentanol;1-Propanol, 3-(dimethylamino)-2,2-dimethyl-;6Z86J68AVL;3-(dimethylamino)-2,2-dimethyl-1-propanol;EINECS 242-791-7;NSC 403920;NSC-403920;NSC403920;1-Propanol,2-dimethyl-;UNII-6Z86J68AVL;SCHEMBL435489;C(N(C)C)C(C)(C)CO;DTXSID0066452;PYEWZDAEJUUIJX-UHFFFAOYSA-;MFCD00059879;3-dimethylamino-2,2-dimethylpropanol;3-dimethylamino-2,2-dimethyl-propanol;AKOS009158904;SB83905;3-dimethylamino-2,2-dimethylpropan-1-ol;BS-21967;3-dimethylamino-2,2-dimethyl-propan-1-ol;CS-0207370;D1727;FT-0615602;3-(dimethylamino)-2,2-dimethyl-propan-1-ol;D89916;EN300-1174608

Chemical Property of 3-Dimethylamino-2,2-dimethyl-1-propanol

Chemical Property:

• Refractive Index: 1.4320-1.4350
• Boiling Point: 185°Cat760mmHg
• Flash Point: 55.1°C
• PSA: 23.47000
• Density: 0.881g/cm³
• LogP: 0.56650
• Storage Temp.: Inert atmosphere,Room Temperature
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 131.131014166
• Heavy Atom Count: 9
• Complexity: 79

Purity/Quality:

98%,99%, ^*data from raw suppliers

3-Dimethylamino-2,2-dimethyl-1-propanol >97.0%(GC)(T) ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(CN(C)C)CO

Technology Process of 3-Dimethylamino-2,2-dimethyl-1-propanol

There total 12 articles about 3-Dimethylamino-2,2-dimethyl-1-propanol which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 47.0%

N,N,2,2-tetramethyl-3-hydroxypropanamide → 3-(dimethylamino)-2,2-dimethylpropan-1-ol (19059-68-8)

Guidance literature:

With dimethylsulfide borane complex; boron trifluoride diethyl etherate; In tetrahydrofuran; at 0 - 45 ℃; for 0.5h;

DOI:10.1039/a608488e

Reference yield:

3-dimethylamino-2,2-dimethylpropanal (15451-14-6) → 3-(dimethylamino)-2,2-dimethylpropan-1-ol (19059-68-8)

Guidance literature:

With methanol; platinum; Hydrogenation;

DOI:10.1021/ja01874a054

Reference yield:

→ 3-(dimethylamino)-2,2-dimethylpropan-1-ol (19059-68-8)

Guidance literature:

With methanol; platinum; Hydrogenation;

DOI:10.1021/ja01874a054

upstream raw materials:

3-dimethylamino-2,2-dimethylpropanal

3-bromo-2,2-dimethyl-propan-1-ol

dimethyl amine

Trimethyl-<3-hydroxy-2.2-dimethyl-propyl>-ammoniumhydroxyd

Downstream raw materials:

4-butoxy-benzoic acid-(3-dimethylamino-2,2-dimethyl-propyl ester)

4-nitro-benzoic acid-(3-dimethylamino-2,2-dimethyl-propyl ester)

benzilic acid-(3-dimethylamino-2,2-dimethyl-propyl ester)

C₃₇H₄₅F₃N₄O₄S

Refernces

• 1、 Madder, Annemieke,Sebastian, Sonny,Van Haver, Dirk,De Clercq, Pierre J.,Maskill, Howard. "Mechanism of esterification of 1,3-dimethylamino alcohols by N-acetylimidazole in acetonitrile and the influence of alkyl and geminal dialkyl substitution upon the rate". . p. 2787 - 2793. Retrieved 2007/10/03.