Home Other Building Blocks 2,2-Dimethyl-3-oxopentanal

2,2-Dimethyl-3-oxopentanal

CAS No.:
106921-60-2
Catalog Number:
AG0032X0
Molecular Formula:
C7H12O2
Molecular Weight:
128.1690
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Product Description
Catalog Number:
AG0032X0
Chemical Name:
2,2-Dimethyl-3-oxopentanal
CAS Number:
106921-60-2
Molecular Formula:
C7H12O2
Molecular Weight:
128.1690
MDL Number:
MFCD11846616
IUPAC Name:
2,2-dimethyl-3-oxopentanal
InChI:
InChI=1S/C7H12O2/c1-4-6(9)7(2,3)5-8/h5H,4H2,1-3H3
InChI Key:
PVYBKZHBCCMBPS-UHFFFAOYSA-N
SMILES:
CCC(=O)C(C=O)(C)C
Properties
Complexity:
125  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.084g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
128.171g/mol
Monoisotopic Mass:
128.084g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties