Home Other Building Blocks 2-(3-ethynylphenyl)propan-2-ol

2-(3-ethynylphenyl)propan-2-ol

CAS No.:
2092412-03-6
Catalog Number:
AG01C045
Molecular Formula:
C11H12O
Molecular Weight:
160.2124
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Product Description
Catalog Number:
AG01C045
Chemical Name:
2-(3-ethynylphenyl)propan-2-ol
CAS Number:
2092412-03-6
Molecular Formula:
C11H12O
Molecular Weight:
160.2124
MDL Number:
MFCD30697591
IUPAC Name:
2-(3-ethynylphenyl)propan-2-ol
InChI:
InChI=1S/C11H12O/c1-4-9-6-5-7-10(8-9)11(2,3)12/h1,5-8,12H,2-3H3
InChI Key:
DDIXBOIRQMMVBE-UHFFFAOYSA-N
SMILES:
C#Cc1cccc(c1)C(O)(C)C
Properties
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.089g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
160.216g/mol
Monoisotopic Mass:
160.089g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties