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87674-93-9 | Acetamide, N-(2-acetyl-4-methyl-3-thienyl)-2-chloro-N-(ethoxymethyl)-
CAS No: 87674-93-9 Catalog No: AG004NZL MDL No:
Product Description
Catalog Number:
AG004NZL
Chemical Name:
Acetamide, N-(2-acetyl-4-methyl-3-thienyl)-2-chloro-N-(ethoxymethyl)-
CAS Number:
87674-93-9
Molecular Formula:
C12H16ClNO3S
Molecular Weight:
289.7783
IUPAC Name:
N-(2-acetyl-4-methylthiophen-3-yl)-2-chloro-N-(ethoxymethyl)acetamide
InChI:
InChI=1S/C12H16ClNO3S/c1-4-17-7-14(10(16)5-13)11-8(2)6-18-12(11)9(3)15/h6H,4-5,7H2,1-3H3
InChI Key:
OIOLFEDUVJNIHV-UHFFFAOYSA-N
SMILES:
CCOCN(c1c(C)csc1C(=O)C)C(=O)CCl
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.054g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
289.774g/mol
Monoisotopic Mass:
289.054g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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