Home Other Building Blocks (2E)-3-(4-ethylphenyl)prop-2-enoic acid

(2E)-3-(4-ethylphenyl)prop-2-enoic acid

CAS No.:
120680-98-0
Catalog Number:
AG00IP2C
Molecular Formula:
C11H12O2
Molecular Weight:
176.2118
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Product Description
Catalog Number:
AG00IP2C
Chemical Name:
(2E)-3-(4-ethylphenyl)prop-2-enoic acid
CAS Number:
120680-98-0
Molecular Formula:
C11H12O2
Molecular Weight:
176.2118
MDL Number:
MFCD02244465
IUPAC Name:
3-(4-ethylphenyl)prop-2-enoic acid
InChI:
InChI=1S/C11H12O2/c1-2-9-3-5-10(6-4-9)7-8-11(12)13/h3-8H,2H2,1H3,(H,12,13)
InChI Key:
GOIIVCHICYNWSG-UHFFFAOYSA-N
SMILES:
CCc1ccc(cc1)/C=C/C(=O)O
Properties
Complexity:
188  
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:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.9  
Properties