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Home Other Building Blocks 1,1-Cyclopentanediacetic acid

1,1-Cyclopentanediacetic acid

CAS No.:
16713-66-9
Catalog Number:
AG001X59
Molecular Formula:
C9H14O4
Molecular Weight:
186.2051
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$19
- +
5g
95%
In Stock USA
United States
$50
- +
25g
95%
In Stock USA
United States
$144
- +
100g
95%
In Stock USA
United States
$500
- +
Product Description
Catalog Number:
AG001X59
Chemical Name:
1,1-Cyclopentanediacetic acid
CAS Number:
16713-66-9
Molecular Formula:
C9H14O4
Molecular Weight:
186.2051
MDL Number:
MFCD00001388
IUPAC Name:
2-[1-(carboxymethyl)cyclopentyl]acetic acid
InChI:
InChI=1S/C9H14O4/c10-7(11)5-9(6-8(12)13)3-1-2-4-9/h1-6H2,(H,10,11)(H,12,13)
InChI Key:
FWPVKDFOUXHOKQ-UHFFFAOYSA-N
SMILES:
OC(=O)CC1(CCCC1)CC(=O)O
EC Number:
240-761-8
NSC Number:
39838
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.089g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
186.207g/mol
Monoisotopic Mass:
186.089g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Literature
Title Journal
Single-step separation of bioactive flavonol glucosides from Osteomeles schwerinae by high-speed counter-current chromatography. Journal of separation science 20100301
Inhibitors of aldose reductase and formation of advanced glycation end-products in moutan cortex (Paeonia suffruticosa). Journal of natural products 20090801
Calorimetric and computational thermochemical study of 3,3-tetramethyleneglutaric acid, 3,3-tetramethyleneglutaric anhydride, and 3,3-tetramethyleneglutarimide. The journal of physical chemistry. A 20081009
Properties