C1OC2=C(O1)C=C(C=C2)CN
CAS: 2620-50-0
Name: 1,3-benzodioxol-5-ylmethanamine
SMILES: C1OC2=C(O1)C=C(C=C2)CN

Molecular Processing

Molecular formula
C8H9NO2
Molecular weight
151.16
Exact mass
151.0633
XLogP
0.87
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
40.46

Supplementary Information

InChIKey: ZILSBZLQGRBMOR-UHFFFAOYSA-N
Synonyme
1,3-Benzodioxole-5-methanamineBenzo-1,3-dioxole-5-methylamineEINECS 220-056-1DTXSID00180836NSC 75851RefChem:565211DTXCID40103327220-056-12620-50-0benzo[d][1,3]dioxol-5-ylmethanamine3,4-Methylenedioxybenzylamine1,3-Benzodioxol-5-ylmethanamine3,4-(Methylenedioxy)benzylamine5-(Aminomethyl)-1,3-benzodioxole1-(1,3-benzodioxol-5-yl)methanamine5-Aminomethyl-1,3-benzodioxoleMFCD00005840NSC-758511,3-benzodioxol-5-ylmethylamineEN300-19047piperonyl aminepiperonyl-amine1-(2H-1,3-BENZODIOXOL-5-YL)METHANAMINENSC75851(1,3-Benzodioxol-5-yl)methylaminePiperonylamine, 97%2HC7X6T2RRSCHEMBL576493,4-methylenedioxy-benzylamine3,4-methylenedioxybenzyl amine
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