Home Other Building Blocks 2-phenylhex-5-enoic acid

2-phenylhex-5-enoic acid

CAS No.:
156297-00-6
Catalog Number:
AG01AF5E
Molecular Formula:
C12H14O2
Molecular Weight:
190.2384
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Product Description
Catalog Number:
AG01AF5E
Chemical Name:
2-phenylhex-5-enoic acid
CAS Number:
156297-00-6
Molecular Formula:
C12H14O2
Molecular Weight:
190.2384
MDL Number:
MFCD20641247
IUPAC Name:
2-phenylhex-5-enoic acid
InChI:
InChI=1S/C12H14O2/c1-2-3-9-11(12(13)14)10-7-5-4-6-8-10/h2,4-8,11H,1,3,9H2,(H,13,14)
InChI Key:
LXIOHNZHJXHBTO-UHFFFAOYSA-N
SMILES:
C=CCCC(c1ccccc1)C(=O)O
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.099g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
190.242g/mol
Monoisotopic Mass:
190.099g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties