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306935-09-1 | 2-Thiophenecarboxylic acid, 3-(dimethylamino)-, methyl ester
CAS No: 306935-09-1 Catalog No: AG0030TT MDL No:
Product Description
Catalog Number:
AG0030TT
Chemical Name:
2-Thiophenecarboxylic acid, 3-(dimethylamino)-, methyl ester
CAS Number:
306935-09-1
Molecular Formula:
C8H11NO2S
Molecular Weight:
185.2434
IUPAC Name:
methyl 3-(dimethylamino)thiophene-2-carboxylate
InChI:
InChI=1S/C8H11NO2S/c1-9(2)6-4-5-12-7(6)8(10)11-3/h4-5H,1-3H3
InChI Key:
WHIJVPBRMXNSMT-UHFFFAOYSA-N
SMILES:
COC(=O)c1sccc1N(C)C
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.051g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.241g/mol
Monoisotopic Mass:
185.051g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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