Home Other Building Blocks 4-Propoxylmandelic acid

4-Propoxylmandelic acid

CAS No.:
79694-16-9
Catalog Number:
AG005IMO
Molecular Formula:
C11H14O4
Molecular Weight:
210.2265
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%(HPLC)
In Stock USA
United States
$180
- +
5g
98%(HPLC)
In Stock USA
United States
$476
- +
Product Description
Catalog Number:
AG005IMO
Chemical Name:
4-Propoxylmandelic acid
CAS Number:
79694-16-9
Molecular Formula:
C11H14O4
Molecular Weight:
210.2265
MDL Number:
MFCD07368282
IUPAC Name:
2-hydroxy-2-(4-propoxyphenyl)acetic acid
InChI:
InChI=1S/C11H14O4/c1-2-7-15-9-5-3-8(4-6-9)10(12)11(13)14/h3-6,10,12H,2,7H2,1H3,(H,13,14)
InChI Key:
UBHMYNPCDNGWBM-UHFFFAOYSA-N
SMILES:
CCCOc1ccc(cc1)C(C(=O)O)O
EC Number:
616-721-4
Properties
Complexity:
197  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.089g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
210.229g/mol
Monoisotopic Mass:
210.089g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties