Home Other Building Blocks 2-(2-methylpropyl)pentanedioic acid

2-(2-methylpropyl)pentanedioic acid

CAS No.:
32806-65-8
Catalog Number:
AG019ZMM
Molecular Formula:
C9H16O4
Molecular Weight:
188.2209
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Product Description
Catalog Number:
AG019ZMM
Chemical Name:
2-(2-methylpropyl)pentanedioic acid
CAS Number:
32806-65-8
Molecular Formula:
C9H16O4
Molecular Weight:
188.2209
MDL Number:
MFCD20639402
IUPAC Name:
2-(2-methylpropyl)pentanedioic acid
InChI:
InChI=1S/C9H16O4/c1-6(2)5-7(9(12)13)3-4-8(10)11/h6-7H,3-5H2,1-2H3,(H,10,11)(H,12,13)
InChI Key:
LHSAKGVBHJUEOV-UHFFFAOYSA-N
SMILES:
CC(CC(C(=O)O)CCC(=O)O)C
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.105g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
188.223g/mol
Monoisotopic Mass:
188.105g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties