COC1=CC=CS1
CAS: 16839-97-7
Name: 2-methoxythiophene
SMILES: COC1=CC=CS1

Molecular Processing

Molecular formula
C5H6OS
Molecular weight
114.17
Exact mass
114.0139
XLogP
1.76
TPSA
9.23
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
7
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
30.87

Supplementary Information

InChIKey: OKEHURCMYKPVFW-UHFFFAOYSA-N
Synonyme
2-Methoxythiophene16839-97-7Thiophene, 2-methoxy-EINECS 240-863-2DTXSID60168559RefChem:87950DTXCID1091050240-863-2InChI=1/C5H6OS/c1-6-5-3-2-4-7-5/h2-4H,1HOKEHURCMYKPVFW-UHFFFAOYSA-N130410-20-72-methoxy-thiopheneMFCD000145262-methoxy thiophene2-Methoxythiophene #2-(methyloxy)thiophene2-Methoxythiophene, 97%SCHEMBL73652SCHEMBL247102SCHEMBL383629SCHEMBL386542SCHEMBL446523CHEBI:229346GEO-01729AKOS000278796AC-4909CS-W001141DS-16448DB-050479M1030
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