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Home Other Building Blocks 3,5-Di-tert-butyl-4-hydroxybenzoic acid

3,5-Di-tert-butyl-4-hydroxybenzoic acid

CAS No.:
1421-49-4
Catalog Number:
AG001HS9
Molecular Formula:
C15H22O3
Molecular Weight:
250.3334
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$19
- +
25g
98%
In Stock USA
United States
$50
- +
100g
98%
In Stock USA
United States
$107
- +
500g
98%
In Stock USA
United States
$375
- +
Product Description
Catalog Number:
AG001HS9
Chemical Name:
3,5-Di-tert-butyl-4-hydroxybenzoic acid
CAS Number:
1421-49-4
Molecular Formula:
C15H22O3
Molecular Weight:
250.3334
MDL Number:
MFCD24369855
IUPAC Name:
3,5-ditert-butyl-4-hydroxybenzoic acid
InChI:
InChI=1S/C15H22O3/c1-14(2,3)10-7-9(13(17)18)8-11(12(10)16)15(4,5)6/h7-8,16H,1-6H3,(H,17,18)
InChI Key:
YEXOWHQZWLCHHD-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C
EC Number:
215-823-2
UNII:
9F0I7YAG34
Properties
Complexity:
285  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.157g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
250.338g/mol
Monoisotopic Mass:
250.157g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4  
Literature
Title Journal
New losartan-hydrocaffeic acid hybrids as antihypertensive-antioxidant dual drugs: Ester, amide and amine linkers. European journal of medicinal chemistry 20120401
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Determination of synthetic phenolic antioxidants and their metabolites in water samples by downscaled solid-phase extraction, silylation and gas chromatography-mass spectrometry. Journal of chromatography. A 20101008
Novel compounds designed as antistress agents. Journal of medicinal chemistry 20091126
Toxicity and effects of 2,6-di-tert-butyl-4-methylphenyl N-methylcarbamate (terbutol) on hepatic cytochrome P450 in F344 rats. Archives of toxicology 20011101
Synergistic protective effects of antioxidant and nitric oxide synthase inhibitor in transient focal ischemia. Journal of cerebral blood flow and metabolism : official journal of the International Society of Cerebral Blood Flow and Metabolism 19990201
Properties