Home Other Building Blocks 3-methyl-2-(propan-2-yl)butanal

3-methyl-2-(propan-2-yl)butanal

CAS No.:
35155-64-7
Catalog Number:
AG01B9E1
Molecular Formula:
C8H16O
Molecular Weight:
128.2120
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01B9E1
Chemical Name:
3-methyl-2-(propan-2-yl)butanal
CAS Number:
35155-64-7
Molecular Formula:
C8H16O
Molecular Weight:
128.2120
MDL Number:
MFCD24674492
IUPAC Name:
3-methyl-2-propan-2-ylbutanal
InChI:
InChI=1S/C8H16O/c1-6(2)8(5-9)7(3)4/h5-8H,1-4H3
InChI Key:
QJQMBKVWUSLXJX-UHFFFAOYSA-N
SMILES:
O=CC(C(C)C)C(C)C
Properties
Complexity:
76.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.12g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
128.215g/mol
Monoisotopic Mass:
128.12g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties