Home Carboxys 5-((4-(tert-butyl)phenoxy)methyl)furan-2-carboxylic acid

5-((4-(tert-butyl)phenoxy)methyl)furan-2-carboxylic acid

CAS No.:
74556-54-0
Catalog Number:
AG00FAO0
Molecular Formula:
C16H18O4
Molecular Weight:
274.3117
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
1 week
United States
$173
- +
1g
1 week
United States
$846
- +
Product Description
Catalog Number:
AG00FAO0
Chemical Name:
5-((4-(tert-butyl)phenoxy)methyl)furan-2-carboxylic acid
CAS Number:
74556-54-0
Molecular Formula:
C16H18O4
Molecular Weight:
274.3117
MDL Number:
MFCD02090869
IUPAC Name:
5-[(4-tert-butylphenoxy)methyl]furan-2-carboxylic acid
InChI:
InChI=1S/C16H18O4/c1-16(2,3)11-4-6-12(7-5-11)19-10-13-8-9-14(20-13)15(17)18/h4-9H,10H2,1-3H3,(H,17,18)
InChI Key:
IBCVBAKAPXHALY-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(o1)COc1ccc(cc1)C(C)(C)C
Properties
Complexity:
326  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.121g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
274.316g/mol
Monoisotopic Mass:
274.121g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
59.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties