Chem 6 Methoxy 2 Naphthaldehyde

Compound 24
  CheckMol                        TMF02:r0:m0
MF=C12H10O2 MW=186.21
 14 15  0  3  0               999 V2000
    0.0000   -0.0000   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0119    1.5175   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2804    2.2762   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5726    1.5293   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2685    3.7937   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    3.8648    2.2880   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5607    4.5524   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    3.8529    3.8055   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    5.1570    1.5530   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    5.1451    4.5642   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    6.4492    2.3118   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    6.4374    3.8174   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    7.7296    4.5761   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0218    3.8411   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4 02  0  1  0  0
  3  5 01  0  1  0  0
  4  6 01  0  1  0  0
  5  7 02  0  1  0  0
  6  8 01  0  2  0  0
  6  9 02  0  1  0  0
  8 10 02  0  1  0  0
  9 11 01  0  1  0  0
 10 12 01  0  1  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
  7  8 01  0  1  0  0
 11 12 02  0  1  0  0
M  END

6-Methoxy-2-Naphthaldehyde

₹ 0.00 0.00

Chemical Name - 6-Methoxy-2-Naphthaldehyde
Mol Weight - 186.209
Smiles - COc1ccc(cc(C=O)cc2)c2c1

Property Name	Property Value
Mol Name	6-Methoxy-2-Naphthaldehyde
Molweight	186.209
Monoisotopic Mass	186.06808
Clogp	2.7173
Clogs	-3.564
H Acceptors	2
Total Surface Area	149.66
Relative Psa	0.15395
Polar Surface Area	26.3
Druglikeness	-3.9857
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	high
Shape Index	0.71429
Molecular Flexibility	0.26167
Molecular Complexity	0.65645
Fragments	1
Non H Atoms	14
Non Ch Atoms	2
Electronegative Atoms	2
Rotatable Bonds	2
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	10
Sp3 Atoms	2
Smiles	COc1ccc(cc(C=O)cc2)c2c1
InChIKey	InChI=1S/C12H10O2/c1-14-12-5-4-10-6-9(8-13)2-3-11(10)7-12/h2-8H,1H3
InChI	VZBLASFLFFMMCM-UHFFFAOYSA-N

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6-Methoxy-2-Naphthaldehyde