Home Other Building Blocks 4-Methylpent-4-enoic acid

4-Methylpent-4-enoic acid

CAS No.:
1001-75-8
Catalog Number:
AG0000XX
Molecular Formula:
C6H10O2
Molecular Weight:
114.1424
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
In Stock USA
United States
$100
- +
1g
97%
In Stock USA
United States
$300
- +
5g
97%
In Stock USA
United States
$900
- +
Product Description
Catalog Number:
AG0000XX
Chemical Name:
4-Methylpent-4-enoic acid
CAS Number:
1001-75-8
Molecular Formula:
C6H10O2
Molecular Weight:
114.1424
MDL Number:
MFCD06208588
IUPAC Name:
4-methylpent-4-enoic acid
InChI:
InChI=1S/C6H10O2/c1-5(2)3-4-6(7)8/h1,3-4H2,2H3,(H,7,8)
InChI Key:
HVHBTFZQLHOFHA-UHFFFAOYSA-N
SMILES:
CC(=C)CCC(=O)O
Properties
Complexity:
105  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
114.068g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
114.144g/mol
Monoisotopic Mass:
114.068g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Literature
Title Journal
Diverting non-haem iron catalysed aliphatic C-H hydroxylations towards desaturations. Nature chemistry 20110301
Properties