Home Other Building Blocks 2-(1-phenylpropoxy)ethan-1-ol

2-(1-phenylpropoxy)ethan-1-ol

CAS No.:
91968-37-5
Catalog Number:
AG01C5BY
Molecular Formula:
C11H16O2
Molecular Weight:
180.2435
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Product Description
Catalog Number:
AG01C5BY
Chemical Name:
2-(1-phenylpropoxy)ethan-1-ol
CAS Number:
91968-37-5
Molecular Formula:
C11H16O2
Molecular Weight:
180.2435
MDL Number:
MFCD28132489
IUPAC Name:
2-(1-phenylpropoxy)ethanol
InChI:
InChI=1S/C11H16O2/c1-2-11(13-9-8-12)10-6-4-3-5-7-10/h3-7,11-12H,2,8-9H2,1H3
InChI Key:
GTHAMPAEWGJKFV-UHFFFAOYSA-N
SMILES:
CCC(c1ccccc1)OCCO
Properties
Complexity:
119  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.115g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
180.247g/mol
Monoisotopic Mass:
180.115g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties