Compound 14
  CheckMol                        TMF02:r0:m0
MF=C10H10O2 MW=162.19
 12 12  0  1  0               999 V2000
    0.0000   -0.0000   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0118   -1.4884   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3230   -2.2208   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2758   -2.2208   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6343   -1.4648   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5634   -1.4648   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9455   -2.1972   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -5.2567   -1.4294   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9573   -3.6856   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -6.5679   -2.1617   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -5.2685   -4.4180   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -6.5797   -3.6502   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  4  6  2  0  0  0  0
  5  7  1  0  0  0  0
  7  8 02  0  1  0  0
  7  9 01  0  1  0  0
  8 10 01  0  1  0  0
  9 11 02  0  1  0  0
 10 12 02  0  1  0  0
 11 12 01  0  1  0  0
M  END

2D Structure

Benzyl Acrylate

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Chemical Name - Benzyl Acrylate
Mol Weight - 162.187
Smiles - C=CC(OCc1ccccc1)=O

Property Name	Property Value
Mol Name	Benzyl Acrylate
Molweight	162.187
Monoisotopic Mass	162.06808
Clogp	1.8158
Clogs	-2.119
H Acceptors	2
Total Surface Area	139.31
Relative Psa	0.16539
Polar Surface Area	26.3
Druglikeness	-13.309
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	low
Shape Index	0.75
Molecular Flexibility	0.47094
Molecular Complexity	0.4621
Fragments	1
Non H Atoms	12
Non Ch Atoms	2
Electronegative Atoms	2
Rotatable Bonds	4
Rings Closures	1
Small Rings	1
Aromatic Rings	1
Aromatic Atoms	6
Sp3 Atoms	2
Symmetric Atoms	2
Smiles	C=CC(OCc1ccccc1)=O
InChIKey	InChI=1S/C10H10O2/c1-2-10(11)12-8-9-6-4-3-5-7-9/h2-7H,1,8H2
InChI	GCTPMLUUWLLESL-UHFFFAOYSA-N

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1 — Benzyl Acrylate | 2 — Benzyl Acrylate