2,3,3-Trimethylpentane

Base Information

• Chemical Name: 2,3,3-Trimethylpentane
• CAS No.: 560-21-4
• Molecular Formula: C8H18
• Molecular Weight: 114.231
• European Community (EC) Number: 209-207-2
• NSC Number: 77447
• UNII: J62AAG7FN0
• DSSTox Substance ID: DTXSID2060333
• Nikkaji Number: J44.096E
• Wikipedia: 2,3,3-Trimethylpentane
• Wikidata: Q2813772
• Mol file: 560-21-4.mol

Synonyms:2,3,3-TRIMETHYLPENTANE;560-21-4;Pentane, 2,3,3-trimethyl-;EINECS 209-207-2;NSC 77447;UNII-J62AAG7FN0;BRN 1696865;J62AAG7FN0;NSC-77447;4-01-00-00445 (Beilstein Handbook Reference);NSC77447;Pentane,3,3-trimethyl-;2,3,3-trimethyl-pentane;Pentano, 2,3,3-trimetil-;DTXSID2060333;CHEBI:143849;C2H5C(CH3)2CH(CH3)2;AKOS006272081;LS-101779;FT-0691352;EN300-7587535;Q2813772;Z1198148974

Chemical Property of 2,3,3-Trimethylpentane

Chemical Property:

• Vapor Pressure: 23.1mmHg at 25°C
• Melting Point: -100.93°C
• Refractive Index: 1.4052
• Boiling Point: 114.9°Cat760mmHg
• Flash Point: 11.4°C
• PSA: 0.00000
• Density: 0.709g/cm³
• LogP: 3.07860
• Storage Temp.: room temp
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 114.140850574
• Heavy Atom Count: 8
• Complexity: 60.4

Purity/Quality:

99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s): F,Xn,N
• Hazard Codes: F,Xn,N
• Statements: 11-38-50/53-65-67
• Safety Statements: 9-16-29-33-60-61-62

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Solvents -> Aliphatics, Saturated (
• Canonical SMILES: CCC(C)(C)C(C)C

Technology Process of 2,3,3-Trimethylpentane

There total 49 articles about 2,3,3-Trimethylpentane 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:

1-butylene (106-98-9,9003-28-5) + (Z)-2-Butene (590-18-1) + trans-2-Butene (624-64-6) + Isobutane (75-28-5,40921-86-6) + 2,2-dimethylpropane (463-82-1) + methyl-cyclopentane (96-37-7) + n-butane (106-97-8,9003-29-6,9021-92-5) → 2,2,6-trimethyloctane (62016-28-8) + 2,4-dimethylpentane (108-08-7) + 2-Methylhexane (591-76-4) + 2,3,3-Trimethyl-pentane (560-21-4) + 2,3,4-trimethylpentane (565-75-3) + 2,2,4-trimethylpentane (540-84-1) + 2,5-dimethylhexane (592-13-2) + 2,3,4-trimethylhexane (921-47-1) + heptane, 3,3,5-trimethyl- (7154-80-5) + 2,3,5-trimethylheptane (20278-85-7) + 2,3,6-trimethylheptane (4032-93-3) + 2,2,4-trimethylheptane (14720-74-2) + 2,3-dimethyl pentane (565-59-3) + 2,3-dimethylhexane (584-94-1,116724-01-7) + 2,4-dimethylhexane (589-43-5) + methylbutane (78-78-4) + 3-methylpentane (96-14-0) + 2-Methylpentane (107-83-5) + 2,3-dimethylbutane (79-29-8) + triptane (464-06-2) + 2,4-dimethylheptane (2213-23-2) + 2,6-dimethylheptane (1072-05-5) + 2,2,5-trimethylhexane (3522-94-9) + cyclohexane (110-82-7,25012-93-5)

Guidance literature:

sulfuric acid; In water; at 1.65666 ℃; under 2963.34 Torr; Product distribution / selectivity;

Reference yield:

propane (74-98-6) → 2,3,3-trimethyloctane + 2-Methylhexane (591-76-4) + 2,3,3-Trimethyl-pentane (560-21-4) + 3,3-dimethylhexane (563-16-6) + 2,3,5-trimethylhexane (1069-53-0) + 4,4-dimethyloctane (15869-95-1) + 2,3,5-trimethylheptane (20278-85-7) + 2,2,4-trimethylheptane (14720-74-2) + 2,3-dimethyl pentane (565-59-3) + 2,3-dimethylhexane (584-94-1,116724-01-7) + 2,4-dimethylhexane (589-43-5) + 2-Methylpentane (107-83-5) + triptane (464-06-2) + 4-methyloctane (2216-34-4) + 3-methyloctane (2216-33-3,116783-15-4) + 2,3,3-trimethylhexane (16747-28-7) + 2,3-dimethylheptane (3074-71-3) + 2,4,6-trimethyloctane (62016-37-9) + tetramethyl-2,3,6,7 octane (52670-34-5) + 3,6-dimethyldecane (17312-53-7)

Guidance literature:

at 20 ℃; under 760.051 Torr; Electric arc;

Reference yield:

1-butylene (106-98-9,9003-28-5) → 2,4-dimethylpentane (108-08-7) + 2,2-dimethylhexane (590-73-8) + 2-methylheptane (592-27-8) + 2,3,3-Trimethyl-pentane (560-21-4) + 2,2,3-trimethylpentane (564-02-3) + 3,3-dimethylhexane (563-16-6) + 2,3,4-trimethylpentane (565-75-3) + 2-methyl-3-ethylpentane (609-26-7) + 4-methylheptane (589-53-7) + octane (111-65-9) + 2,2,4-trimethylpentane (540-84-1) + 2,5-dimethylhexane (592-13-2) + 3,4-dimethylhexane (583-48-2) + 2,3-dimethylhexane (584-94-1,116724-01-7) + 2,4-dimethylhexane (589-43-5) + 3-methylheptane (589-81-1)

Guidance literature:

1-butylene; With water; at 25 - 40 ℃;

at 125 - 240 ℃; under 52505.3 Torr;

With hydrogen; 0.5% Pt/Al2O3;

upstream raw materials:

tetralin

2-chloro-2,3-dimethylbutane

diethylzinc

2-methyl-2-butylchloride

Downstream raw materials:

triptane

2,3-dimethyl pentane

m-xylene

Refernces

• 1、 -. "GAS-TO-GAS REACTOR AND METHOD OF USING". Paragraph 0176-0178. . Retrieved 2021/02/05.
• 2、 -. "GAS-TO-LIQUID REACTOR AND METHOD OF USING". Paragraph 0140-0142. . Retrieved 2019/08/15.