Home Other Building Blocks (E)-5-Phenyl-2-pentenoic acid

(E)-5-Phenyl-2-pentenoic acid

CAS No.:
55320-96-2
Catalog Number:
AG00DSXJ
Molecular Formula:
C11H12O2
Molecular Weight:
176.2118
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00DSXJ
Chemical Name:
(E)-5-Phenyl-2-pentenoic acid
CAS Number:
55320-96-2
Molecular Formula:
C11H12O2
Molecular Weight:
176.2118
MDL Number:
MFCD18972297
IUPAC Name:
5-phenylpent-2-enoic acid
InChI:
InChI=1S/C11H12O2/c12-11(13)9-5-4-8-10-6-2-1-3-7-10/h1-3,5-7,9H,4,8H2,(H,12,13)
InChI Key:
IATNQCGERGDVDN-UHFFFAOYSA-N
SMILES:
OC(=O)/C=C/CCc1ccccc1
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.084g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
176.215g/mol
Monoisotopic Mass:
176.084g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.5  
Properties