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2583-25-7

2583-25-7 | 2-Allylmalonic acid

CAS No: 2583-25-7 Catalog No: AG003NQI MDL No:MFCD00014347

Product Description

Catalog Number:
AG003NQI
Chemical Name:
2-Allylmalonic acid
CAS Number:
2583-25-7
Molecular Formula:
C6H8O4
Molecular Weight:
144.1253
MDL Number:
MFCD00014347
IUPAC Name:
2-prop-2-enylpropanedioic acid
InChI:
InChI=1S/C6H8O4/c1-2-3-4(5(7)8)6(9)10/h2,4H,1,3H2,(H,7,8)(H,9,10)
InChI Key:
ZDZVKPXKLLLOOA-UHFFFAOYSA-N
SMILES:
C=CCC(C(=O)O)C(=O)O
EC Number:
219-958-8
NSC Number:
46718

Properties

Complexity:
147  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.042g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
144.126g/mol
Monoisotopic Mass:
144.042g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  

Literature

Title Journal
Allylmalonate as an activator subunit for the initiation of relay ring-closing metathesis reactions. Angewandte Chemie (International ed. in English) 20110225
Dispersion behavior of zirconia nanocrystals and their surface functionalization with vinyl group-containing ligands. Langmuir : the ACS journal of surfaces and colloids 20070828

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