CN(C)C1=C2C(=C(S1)C=O)OCCO2
Name: 5-(dimethylamino)-2,3-dihydrothieno[3,4-b][1,4]dioxine-7-carbaldehyde
SMILES: CN(C)C1=C2C(=C(S1)C=O)OCCO2

Molecular Processing

Molecular formula
C9H11NO3S
Molecular weight
213.26
Exact mass
213.046
XLogP
1.4
TPSA
38.77
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.444
Molar refractivity
55.02

Supplementary Information

InChIKey: DMZBSLKCHXOMPT-UHFFFAOYSA-N
Synonyme
SCHEMBL5406455DMZBSLKCHXOMPT-UHFFFAOYSA-N7-dimethylamino-2,3-dihydro-thieno[3,4-b][1,4]dioxine-5-carbaldehyde
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