Home Other Building Blocks 1-[4-(pentan-3-yloxy)phenyl]ethan-1-ol

1-[4-(pentan-3-yloxy)phenyl]ethan-1-ol

CAS No.:
1523303-48-1
Catalog Number:
AG01C1SE
Molecular Formula:
C13H20O2
Molecular Weight:
208.2967
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Product Description
Catalog Number:
AG01C1SE
Chemical Name:
1-[4-(pentan-3-yloxy)phenyl]ethan-1-ol
CAS Number:
1523303-48-1
Molecular Formula:
C13H20O2
Molecular Weight:
208.2967
MDL Number:
MFCD23833481
IUPAC Name:
1-(4-pentan-3-yloxyphenyl)ethanol
InChI:
InChI=1S/C13H20O2/c1-4-12(5-2)15-13-8-6-11(7-9-13)10(3)14/h6-10,12,14H,4-5H2,1-3H3
InChI Key:
WXFUNGQGERAUGR-UHFFFAOYSA-N
SMILES:
CCC(Oc1ccc(cc1)C(O)C)CC
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.146g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
208.301g/mol
Monoisotopic Mass:
208.146g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties