Home Other Building Blocks 4-methylhexa-3,5-dienoic acid

4-methylhexa-3,5-dienoic acid

CAS No.:
128961-60-4
Catalog Number:
AG01AF7C
Molecular Formula:
C7H10O2
Molecular Weight:
126.1531
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01AF7C
Chemical Name:
4-methylhexa-3,5-dienoic acid
CAS Number:
128961-60-4
Molecular Formula:
C7H10O2
Molecular Weight:
126.1531
MDL Number:
MFCD19228295
IUPAC Name:
4-methylhexa-3,5-dienoic acid
InChI:
InChI=1S/C7H10O2/c1-3-6(2)4-5-7(8)9/h3-4H,1,5H2,2H3,(H,8,9)
InChI Key:
BFUYPWNVMSXEQU-UHFFFAOYSA-N
SMILES:
CC(=CCC(=O)O)C=C
Properties
Complexity:
145  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.068g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
126.155g/mol
Monoisotopic Mass:
126.068g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
1.8  
Properties