Home Carboxys 4-Methylcyclohexa-1,4-diene-1-carboxylic acid

4-Methylcyclohexa-1,4-diene-1-carboxylic acid

CAS No.:
53312-53-1
Catalog Number:
AG01DTSW
Molecular Formula:
C8H10O2
Molecular Weight:
138.1638
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$104
- +
250mg
95%
In Stock USA
United States
$189
- +
1g
95%
In Stock USA
United States
$378
- +
Product Description
Catalog Number:
AG01DTSW
Chemical Name:
4-Methylcyclohexa-1,4-diene-1-carboxylic acid
CAS Number:
53312-53-1
Molecular Formula:
C8H10O2
Molecular Weight:
138.1638
MDL Number:
MFCD19228627
IUPAC Name:
4-methylcyclohexa-1,4-diene-1-carboxylic acid
InChI:
InChI=1S/C8H10O2/c1-6-2-4-7(5-3-6)8(9)10/h2,5H,3-4H2,1H3,(H,9,10)
InChI Key:
XLCSLJJQJLQYLO-UHFFFAOYSA-N
SMILES:
CC1=CCC(=CC1)C(=O)O
Properties
Complexity:
211  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.068g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
138.166g/mol
Monoisotopic Mass:
138.068g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties