C1=CSC(=C1)C(=O)O
CAS: 527-72-0
Nombre: thiophene-2-carboxylic acid
SMILES: C1=CSC(=C1)C(=O)O

Molecular Processing

Molecular formula
C5H4O2S
Molecular weight
128.15
Exact mass
127.9932
XLogP
1.45
TPSA
37.3
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
8
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0
Molar refractivity
31.28

Supplementary Information

InChIKey: QERYCTSHXKAMIS-UHFFFAOYSA-N
Sinónimos
2-Thiophenecarboxylic acid527-72-02-Thenoic acid2-Carboxythiophene2-Thienylcarboxylic acidTenoic acid2-TCAThenoic acidNSC 2188EINECS 208-423-4Rhinotrophyl (TN)BRN 0110150Tenoic acid (DCF)AI3-16118NSC-2188Thiophene-2-carbixylic acidTHENOIC ACID [WHO-DD]DTXSID20601775-18-06-00158 (Beilstein Handbook Reference)2-THIOPHENECARBOXYLIC ACID [MI]Rhinotrophyl2Carboxythiophene2Thenoic acid2Thiophenic acidThiophene2carboxylate2Thienylcarboxylic acidThiophene2carboxylic acidRefChem:483774alphaThiophenecarboxylic acidDTXCID7041259
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