Home Carboxys Cyclopentane-1,3-dicarboxylic acid

Cyclopentane-1,3-dicarboxylic acid

CAS No.:
4056-78-4
Catalog Number:
AG0076HP
Molecular Formula:
C7H10O4
Molecular Weight:
158.1519
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$47
- +
1g
95%
In Stock USA
United States
$90
- +
5g
95%
In Stock USA
United States
$236
- +
10g
95%
In Stock USA
United States
$432
- +
Product Description
Catalog Number:
AG0076HP
Chemical Name:
Cyclopentane-1,3-dicarboxylic acid
CAS Number:
4056-78-4
Molecular Formula:
C7H10O4
Molecular Weight:
158.1519
MDL Number:
MFCD01735467
IUPAC Name:
cyclopentane-1,3-dicarboxylic acid
InChI:
InChI=1S/C7H10O4/c8-6(9)4-1-2-5(3-4)7(10)11/h4-5H,1-3H2,(H,8,9)(H,10,11)
InChI Key:
LNGJOYPCXLOTKL-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCC(C1)C(=O)O
Properties
Complexity:
167  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.058g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
158.153g/mol
Monoisotopic Mass:
158.058g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties