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Home Other Building Blocks P-Phenylenedipropionic acid

P-Phenylenedipropionic acid

CAS No.:
4251-21-2
Catalog Number:
AG007274
Molecular Formula:
C12H14O4
Molecular Weight:
222.2372
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$100
- +
5g
97%
In Stock USA
United States
$300
- +
10g
97%
In Stock USA
United States
$450
- +
25g
97%
In Stock USA
United States
$900
- +
Product Description
Catalog Number:
AG007274
Chemical Name:
P-Phenylenedipropionic acid
CAS Number:
4251-21-2
Molecular Formula:
C12H14O4
Molecular Weight:
222.2372
MDL Number:
MFCD00002779
IUPAC Name:
3-[4-(2-carboxyethyl)phenyl]propanoic acid
InChI:
InChI=1S/C12H14O4/c13-11(14)7-5-9-1-2-10(4-3-9)6-8-12(15)16/h1-4H,5-8H2,(H,13,14)(H,15,16)
InChI Key:
DFOCUWFSRVQSNI-UHFFFAOYSA-N
SMILES:
OC(=O)CCc1ccc(cc1)CCC(=O)O
EC Number:
224-215-6
Properties
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.089g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
222.24g/mol
Monoisotopic Mass:
222.089g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Literature
Title Journal
Rational synthesis of supramolecular assemblies based on tetraplatinum units: synthesis, characterization, and selective substitution reactions of four different Pt4 clusters. Chemistry (Weinheim an der Bergstrasse, Germany) 20110321
Properties