Home Other Building Blocks 2-(2,4-Di-tert-pentylphenoxy)butanoic acid

2-(2,4-Di-tert-pentylphenoxy)butanoic acid

CAS No.:
13403-01-5
Catalog Number:
AG00804H
Molecular Formula:
C20H32O3
Molecular Weight:
320.4663
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
1 week
United States
$121
- +
5g
1 week
United States
$235
- +
10g
1 week
United States
$388
- +
25g
1 week
United States
$694
- +
Product Description
Catalog Number:
AG00804H
Chemical Name:
2-(2,4-Di-tert-pentylphenoxy)butanoic acid
CAS Number:
13403-01-5
Molecular Formula:
C20H32O3
Molecular Weight:
320.4663
MDL Number:
MFCD00045895
IUPAC Name:
2-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoic acid
InChI:
InChI=1S/C20H32O3/c1-8-16(18(21)22)23-17-12-11-14(19(4,5)9-2)13-15(17)20(6,7)10-3/h11-13,16H,8-10H2,1-7H3,(H,21,22)
InChI Key:
PHCYXPLSQNMCRY-UHFFFAOYSA-N
SMILES:
CCC(C(=O)O)Oc1ccc(cc1C(CC)(C)C)C(CC)(C)C
EC Number:
236-495-7
Properties
Complexity:
386  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
320.235g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
320.473g/mol
Monoisotopic Mass:
320.235g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
6.8  
Properties