2-chloro-N-(3-cyanothiophen-2-yl)acetamide

2-chloro-N-(3-cyanothiophen-2-yl)acetamide

CAS: 55654-19-8

Formula: C7H5ClN2OS

SMILES: ClCC(=O)NC1=C(C=CS1)C#N

IUPAC: 2-chloro-N-(3-cyanothiophen-2-yl)acetamide

InChI: InChI=1S/C7H5ClN2OS/c8-3-6(11)10-7-5(4-9)1-2-12-7/h1-2H,3H2,(H,10,11)

Composition: C (41.90%), H (2.51%), Cl (17.67%), N (13.96%), O (7.97%), S (15.98%)

Molar Mass: 200.64

Atom Count: 17

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	199.9811117
Formal Charge	0
FSP3	0.14
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	ZONGUZTWVAWQDI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	47.66
Topological Polar Surface Area	52.89
Polarizability	17.67
Ring Count	1
Rotatable Bond Count	2

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