6-methoxypyridine-3-carbothioamide

6-methoxypyridine-3-carbothioamide

CAS: 175277-49-3

Formula: C7H8N2OS

SMILES: COC1=CC=C(C=N1)C(N)=S

IUPAC: 6-methoxypyridine-3-carbothioamide

InChI: InChI=1S/C7H8N2OS/c1-10-6-3-2-5(4-9-6)7(8)11/h2-4H,1H3,(H2,8,11)

Composition: C (49.98%), H (4.79%), N (16.65%), O (9.51%), S (19.06%)

Molar Mass: 168.21

Atom Count: 19

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	168.03573406
Formal Charge	0
FSP3	0.14
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	YAKXWVMVPOHRGZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	47.75
Topological Polar Surface Area	48.14
Polarizability	18.15
Ring Count	1
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	175277-49-3		$50.44-$75.66$50.44$75.66