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88770-18-7 | Methyl 5-methylthiophene-3-carboxylate
CAS No: 88770-18-7 Catalog No: AG0039VZ MDL No:MFCD02245126
Product Description
Catalog Number:
AG0039VZ
Chemical Name:
Methyl 5-methylthiophene-3-carboxylate
CAS Number:
88770-18-7
Molecular Formula:
C7H8O2S
Molecular Weight:
156.2022
MDL Number:
MFCD02245126
IUPAC Name:
methyl 5-methylthiophene-3-carboxylate
InChI:
InChI=1S/C7H8O2S/c1-5-3-6(4-10-5)7(8)9-2/h3-4H,1-2H3
InChI Key:
DSVLFSAWVFGCEJ-UHFFFAOYSA-N
SMILES:
COC(=O)c1csc(c1)C
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.025g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.199g/mol
Monoisotopic Mass:
156.025g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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