Home Other Building Blocks (3-acetylphenyl)methyl acetate

(3-acetylphenyl)methyl acetate

CAS No.:
500129-36-2
Catalog Number:
AG01EJYN
Molecular Formula:
C11H12O3
Molecular Weight:
192.2112
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Product Description
Catalog Number:
AG01EJYN
Chemical Name:
(3-acetylphenyl)methyl acetate
CAS Number:
500129-36-2
Molecular Formula:
C11H12O3
Molecular Weight:
192.2112
MDL Number:
MFCD30592276
IUPAC Name:
(3-acetylphenyl)methyl acetate
InChI:
InChI=1S/C11H12O3/c1-8(12)11-5-3-4-10(6-11)7-14-9(2)13/h3-6H,7H2,1-2H3
InChI Key:
DPMQCPITVDPABA-UHFFFAOYSA-N
SMILES:
CC(=O)OCc1cccc(c1)C(=O)C
Properties
Complexity:
223  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.079g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.214g/mol
Monoisotopic Mass:
192.079g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties