Text Search
Structure Search

N-{[5-(2-chloroacetyl)thiophen-2-yl]methyl}acetamide

N-{[5-(2-chloroacetyl)thiophen-2-yl]methyl}acetamide

Formula: C9H10ClNO2S

SMILES: CC(=O)NCC1=CC=C(S1)C(=O)CCl

IUPAC: N-{[5-(2-chloroacetyl)thiophen-2-yl]methyl}acetamide

InChI: InChI=1S/C9H10ClNO2S/c1-6(12)11-5-7-2-3-9(14-7)8(13)4-10/h2-3H,4-5H2,1H3,(H,11,12)

Composition: C (46.66%), H (4.35%), Cl (15.30%), N (6.05%), O (13.81%), S (13.84%)

Molar Mass: 231.69

Atom Count: 24

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 231.0120774
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey BBDWEMUVRXBMRC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 55.81
Topological Polar Surface Area 46.17
Polarizability 21.4
Ring Count 1
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C9H10ClNO2S Quote Only