Home Other Building Blocks methyl 4-butoxy-2-hydroxybenzoate

methyl 4-butoxy-2-hydroxybenzoate

CAS No.:
86840-96-2
Catalog Number:
AG01BCQ7
Molecular Formula:
C12H16O4
Molecular Weight:
224.2530
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Product Description
Catalog Number:
AG01BCQ7
Chemical Name:
methyl 4-butoxy-2-hydroxybenzoate
CAS Number:
86840-96-2
Molecular Formula:
C12H16O4
Molecular Weight:
224.2530
MDL Number:
MFCD01099059
IUPAC Name:
methyl 4-butoxy-2-hydroxybenzoate
InChI:
InChI=1S/C12H16O4/c1-3-4-7-16-9-5-6-10(11(13)8-9)12(14)15-2/h5-6,8,13H,3-4,7H2,1-2H3
InChI Key:
FLHQOBMRZRWHNH-UHFFFAOYSA-N
SMILES:
CCCCOc1ccc(c(c1)O)C(=O)OC
Properties
Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.105g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
224.256g/mol
Monoisotopic Mass:
224.105g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties