Home Other Building Blocks 2163-42-0
2163-42-0,MFCD00082586
Catalog No.:AA003HIA
2163-42-0 | 2-Methylpropane-1,3-diol
Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
99%
in stock  
$27.00
- +
25g
99%
in stock  
$41.00
- +
100g
99%
in stock  
$69.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003HIA
Chemical Name:
2-Methylpropane-1,3-diol
CAS Number:
2163-42-0
Molecular Formula:
C4H10O2
Molecular Weight:
90.1210
MDL Number:
MFCD00082586
IUPAC Name:
2-methylpropane-1,3-diol
InChI:
InChI=1S/C4H10O2/c1-4(2-5)3-6/h4-6H,2-3H2,1H3
InChI Key:
QWGRWMMWNDWRQN-UHFFFAOYSA-N
SMILES:
OCC(CO)C
UNII:
N8F53B3R4R
Properties
Computed Properties
 
Complexity:
24.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
90.068g/mol
Formal Charge:
0
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
90.122g/mol
Monoisotopic Mass:
90.068g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  

Synonyms
 
2-methyl-1,3-propanediol 
2-Methyl-1,3-propanediol 
QWGRWMMWNDWRQN-UHFFFAOYSA-N 
methyl propanediol 
mpdiol(r) 
mpdiol(r) glycol 
2-methyl-3-propanediol 
ACMC-1CDKN 
2-methypropan-1,3-diol 
DSSTox_CID_9231 
2-methyl-1,3-propandiol 
2-methylpropan-1,3-diol 
2-Methylpropane-1,3-diol 
3-propanediol,2-methyl-1 
AC1L2O1O 
AC1Q7BJ1 
2-methyl-propan-1,3-diol 
DSSTox_RID_78720 
2-methyl-propane-1,3-diol 
DSSTox_GSID_29231 
CHEMBL3183047 
DTXSID3029231 
CTK3I9658 
2163-42-0 
HSDB 7267 
KS-00000UNW 
QWGRWMMWNDWRQN-UHFFFAOYSA- 
2-Methyl-1,3-propanediol, 99% 
ZINC1841391 
Tox21_200047 
ANW-24525 
MFCD00082586 
AKOS015856381 
MCULE-2340730326 
1,3-Propanediol, 2-methyl- 
NE11200 
RTR-032027 
TRA-0183625 
NCGC00248505-01 
NCGC00257601-01 
AJ-31789 
AN-50481 
S032 
SC-20510 
CAS-2163-42-0 
MP diol glycol 
ST2417107 
TR-032027 
FT-0082725 
FT-0612887 
M1114 
EN300-85197 
I14-18564 
F0001-0772 
InChI=1/C4H10O2/c1-4(2-5)3-6/h4-6H,2-3H2,1H3 
methylpropanediol 
1,3-Dihydroxy-2-methylpropane 
DIETHYL PROPYLMALONATE 
C4H10O2 
CID75103 
AR-1E4158 
2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL 
2,2,2-Trifluoro-1-(trifluoromethyl)ethyl acrylate 
102940-86-3 
22176-45-0 
TRS 
UNII-N8F53B3R4R 
N8F53B3R4R 
Propane-1,3-diol, 2-methyl- 
Literature

Title: The transcription factor AmrZ utilizes multiple DNA binding modes to recognize activator and repressor sequences of Pseudomonas aeruginosa virulence genes.

Journal: PLoS pathogens 20120401

Title: Direct generation of acyclic polypropionate stereopolyads via double diastereo- and enantioselective iridium-catalyzed crotylation of 1,3-diols: beyond stepwise carbonyl addition in polyketide construction.

Journal: Journal of the American Chemical Society 20110817

Title: Optimization of culture conditions to produce high yields of active Acetobacter sp. CCTCC M209061 cells for anti-Prelog reduction of prochiral ketones.

Journal: BMC biotechnology 20110101

Title: Inducing single-molecule magnetism in a family of loop-of-loops aggregates: heterometallic Mn(40)Na(4) clusters and the homometallic Mn(44) analogue.

Journal: Journal of the American Chemical Society 20101117

Title: A Mn₁₅ single-molecule magnet consisting of a supertetrahedron incorporated in a loop.

Journal: Dalton transactions (Cambridge, England : 2003) 20100528

Title: The difficult case of crystallization and structure solution for the ParC55 breakage-reunion domain of topoisomerase IV from Streptococcus pneumoniae.

Journal: PloS one 20080101

Title: Regulated-stereoselective construction of thirteen stereogenic centers necessary for the frame of (+)-discodermolide, based on iterative Lewis acid-promoted aldol reactions.

Journal: The Journal of organic chemistry 20031017

Title: A multiphasic hollow fiber reactor for the whole-cell bioconversion of 2-methyl-1,3-propanediol to (r)-beta-hydroxyisobutyric acid.

Journal: Biotechnology progress 20010101

Quotation Request
Company Name:
*
Contact Person:
*
Email:
*
Quantity Required:
*
Additional Info: