Home Other Building Blocks 2,4-Dimethylcinnamic acid

2,4-Dimethylcinnamic acid

CAS No.:
1685-80-9
Catalog Number:
AG001Y47
Molecular Formula:
C11H12O2
Molecular Weight:
176.2118
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$32
- +
5g
95%
In Stock USA
United States
$75
- +
10g
95%
In Stock USA
United States
$113
- +
25g
95%
In Stock USA
United States
$225
- +
100g
95%
In Stock USA
United States
$563
- +
Product Description
Catalog Number:
AG001Y47
Chemical Name:
2,4-Dimethylcinnamic acid
CAS Number:
1685-80-9
Molecular Formula:
C11H12O2
Molecular Weight:
176.2118
MDL Number:
MFCD00017287
IUPAC Name:
(E)-3-(2,4-dimethylphenyl)prop-2-enoic acid
InChI:
InChI=1S/C11H12O2/c1-8-3-4-10(9(2)7-8)5-6-11(12)13/h3-7H,1-2H3,(H,12,13)/b6-5+
InChI Key:
UFSZMHHSCOXWPC-AATRIKPKSA-N
SMILES:
OC(=O)C=Cc1ccc(cc1C)C
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
176.084g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
176.215g/mol
Monoisotopic Mass:
176.084g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties