Home Other Building Blocks 4-butoxy-2-hydroxybenzoic acid

4-butoxy-2-hydroxybenzoic acid

CAS No.:
29264-27-5
Catalog Number:
AG01BCQ8
Molecular Formula:
C11H14O4
Molecular Weight:
210.2265
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Product Description
Catalog Number:
AG01BCQ8
Chemical Name:
4-butoxy-2-hydroxybenzoic acid
CAS Number:
29264-27-5
Molecular Formula:
C11H14O4
Molecular Weight:
210.2265
MDL Number:
MFCD01099011
IUPAC Name:
4-butoxy-2-hydroxybenzoic acid
InChI:
InChI=1S/C11H14O4/c1-2-3-6-15-8-4-5-9(11(13)14)10(12)7-8/h4-5,7,12H,2-3,6H2,1H3,(H,13,14)
InChI Key:
RNGFVIMNTYOBTK-UHFFFAOYSA-N
SMILES:
CCCCOc1ccc(c(c1)O)C(=O)O
Properties
Complexity:
205  
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Literature
Title Journal
Potential antifungal benzhydrazides. Journal of medicinal and pharmaceutical chemistry 19610301
Properties