Home Other Building Blocks 1-(4-methylphenyl)butan-2-ol

1-(4-methylphenyl)butan-2-ol

CAS No.:
110661-89-7
Catalog Number:
AG019S4V
Molecular Formula:
C11H16O
Molecular Weight:
164.2441
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Product Description
Catalog Number:
AG019S4V
Chemical Name:
1-(4-methylphenyl)butan-2-ol
CAS Number:
110661-89-7
Molecular Formula:
C11H16O
Molecular Weight:
164.2441
MDL Number:
MFCD11934523
IUPAC Name:
1-(4-methylphenyl)butan-2-ol
InChI:
InChI=1S/C11H16O/c1-3-11(12)8-10-6-4-9(2)5-7-10/h4-7,11-12H,3,8H2,1-2H3
InChI Key:
FYGLQZUWRNFUKW-UHFFFAOYSA-N
SMILES:
CCC(Cc1ccc(cc1)C)O
Properties
Complexity:
114  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.12g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
164.248g/mol
Monoisotopic Mass:
164.12g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties