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143717-66-2

143717-66-2 | Benzenemethanol, 4-ethenyl-, 1-propanoate

CAS No: 143717-66-2 Catalog No: AG001I96 MDL No:

Product Description

Catalog Number:
AG001I96
Chemical Name:
Benzenemethanol, 4-ethenyl-, 1-propanoate
CAS Number:
143717-66-2
Molecular Formula:
C12H14O2
Molecular Weight:
190.2384
IUPAC Name:
(4-ethenylphenyl)methanol;propanoic acid
InChI:
InChI=1S/C9H10O.C3H6O2/c1-2-8-3-5-9(7-10)6-4-8;1-2-3(4)5/h2-6,10H,1,7H2;2H2,1H3,(H,4,5)
InChI Key:
WYEVIHXJZAXROJ-UHFFFAOYSA-N
SMILES:
CCC(=O)OCc1ccc(cc1)C=C

Properties

Complexity:
142  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.11g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
208.257g/mol
Monoisotopic Mass:
208.11g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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