CC1=CC=CS1
CAS: 554-14-3
Name: 2-methylthiophene
SMILES: CC1=CC=CS1

Molecular Processing

Molecular formula
C5H6S
Molecular weight
98.17
Exact mass
98.019
XLogP
2.06
TPSA
0
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
6
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
29.06

Supplementary Information

InChIKey: XQQBUAPQHNYYRS-UHFFFAOYSA-N
Synonyme
2-METHYLTHIOPHENE554-14-3Thiophene, 2-methyl-alpha-MethylthiopheneCCRIS 29362-Methylthiacyclopentadiene2-thiotolene2-methylthiophenEINECS 209-063-0BRN 0103734AI3-159117115JAP77A.ALPHA.-METHYLTHIOPHENEDTXSID3060291FEMA NO. 4928CHEBI:141567alphaMethylthiopheneThiophene, 2methylRefChem:476298DTXCID7041883209-063-0InChI=1/C5H6S/c1-5-3-2-4-6-5/h2-4H,1H2-methyl thiophene2-methyl-thiopheneC5H6SMFCD0000545125154-40-9Thiophene, methyl-UNII-7115JAP77Aa-Thiotolene
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