Home Other Building Blocks 4-(4-tert-butylphenyl)-4-hydroxybutanoic acid

4-(4-tert-butylphenyl)-4-hydroxybutanoic acid

CAS No.:
89224-21-5
Catalog Number:
AG01A9N8
Molecular Formula:
C14H20O3
Molecular Weight:
236.3068
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Product Description
Catalog Number:
AG01A9N8
Chemical Name:
4-(4-tert-butylphenyl)-4-hydroxybutanoic acid
CAS Number:
89224-21-5
Molecular Formula:
C14H20O3
Molecular Weight:
236.3068
MDL Number:
MFCD09890985
IUPAC Name:
4-(4-tert-butylphenyl)-4-hydroxybutanoic acid
InChI:
InChI=1S/C14H20O3/c1-14(2,3)11-6-4-10(5-7-11)12(15)8-9-13(16)17/h4-7,12,15H,8-9H2,1-3H3,(H,16,17)
InChI Key:
HRDCKZDIDSYJEJ-UHFFFAOYSA-N
SMILES:
OC(c1ccc(cc1)C(C)(C)C)CCC(=O)O
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.141g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
236.311g/mol
Monoisotopic Mass:
236.141g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties