Home Other Building Blocks 1-phenylpent-4-yn-1-ol

1-phenylpent-4-yn-1-ol

CAS No.:
19082-37-2
Catalog Number:
AG01DZ7H
Molecular Formula:
C11H12O
Molecular Weight:
160.2124
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Product Description
Catalog Number:
AG01DZ7H
Chemical Name:
1-phenylpent-4-yn-1-ol
CAS Number:
19082-37-2
Molecular Formula:
C11H12O
Molecular Weight:
160.2124
MDL Number:
MFCD16091500
IUPAC Name:
1-phenylpent-4-yn-1-ol
InChI:
InChI=1S/C11H12O/c1-2-3-9-11(12)10-7-5-4-6-8-10/h1,4-8,11-12H,3,9H2
InChI Key:
KLCFSSYQMSYTTN-UHFFFAOYSA-N
SMILES:
OC(c1ccccc1)CCC#C
Properties
Complexity:
159  
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:
3  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties