C1=CC=C2C(=C1)OC(O2)CN
CAS: 936-78-7
Nombre: 1,3-benzodioxol-2-ylmethanamine
SMILES: C1=CC=C2C(=C1)OC(O2)CN

Molecular Processing

Molecular formula
C8H9NO2
Molecular weight
151.16
Exact mass
151.0633
XLogP
0.74
TPSA
44.48
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
11
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
40.54

Supplementary Information

InChIKey: NYGUTNGOSYLYKD-UHFFFAOYSA-N
Sinónimos
2-(Aminomethyl)-1,3-benzodioxole936-78-71,3-benzodioxol-2-ylmethanamineMFCD188054791,3-Benzodioxole-2-methanamine1-(2H-1,3-Benzodioxol-2-yl)methanamineSCHEMBL437597SCHEMBL4621703SCHEMBL4769203DTXSID607233842-(Aminomethyl)-13-benzodioxoleNYGUTNGOSYLYKD-UHFFFAOYSA-NAC2204AKOS022904321C-benzo[1,3]dioxol-2-yl-methylamineCS-11631DA-30293SY0269982-(Aminomethyl)-1 pound not3-benzodioxole
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