4-formyl-1-methylpyridin-1-ium benzenesulfonate

4-formyl-1-methylpyridin-1-ium benzenesulfonate

CAS: 82228-89-5

Formula: C13H13NO4S

SMILES: C[N+]1=CC=C(C=O)C=C1.[O-]S(=O)(=O)C1=CC=CC=C1

IUPAC: 4-formyl-1-methylpyridin-1-ium benzenesulfonate

InChI: InChI=1S/C7H8NO.C6H6O3S/c1-8-4-2-7(6-9)3-5-8;7-10(8,9)6-4-2-1-3-5-6/h2-6H,1H3;1-5H,(H,7,8,9)/q+1;/p-1

Composition: C (55.90%), H (4.69%), N (5.01%), O (22.91%), S (11.48%)

Molar Mass: 279.31

Atom Count: 32

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	279.056529077
Formal Charge	0
FSP3	0.08
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	HSVLGIFAXFDLMU-UHFFFAOYSA-M
Lipinski's Rule of Five	1
Molar Refractivity	35.56
Topological Polar Surface Area	57.2
Polarizability	14.86
Ring Count	2
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<7 Days	82228-89-5		$172.98-$1,215.50$172.98$241.23$478.72$1,215.50

Molecule Market Select

Purity	LeadTime	CAS		UnitPrice
98%	<10 Days	82228-89-5		Quote Only

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<7 Days	82228-89-5		$7.25-$964.62$7.25$10.35$22.77$93.15$155.25$339.48$964.62

AA BLOCKS INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<6 Days	82228-89-5		$77.05-$910.80$77.05$103.50$155.25$341.55$910.80

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	82228-89-5		$554.00$554.00