6,7-dimethoxy-1-(pyridin-3-yl)-1,2,3,4-tetrahydroisoquinoline; oxalic acid

6,7-dimethoxy-1-(pyridin-3-yl)-1,2,3,4-tetrahydroisoquinoline; oxalic acid

CAS: 1609402-93-8

Formula: C18H20N2O6

SMILES: OC(=O)C(O)=O.COC1=CC2=C(C=C1OC)C(NCC2)C1=CN=CC=C1

IUPAC: 6,7-dimethoxy-1-(pyridin-3-yl)-1,2,3,4-tetrahydroisoquinoline; oxalic acid

InChI: InChI=1/C16H18N2O2.C2H2O4/c1-19-14-8-11-5-7-18-16(12-4-3-6-17-10-12)13(11)9-15(14)20-2;3-1(4)2(5)6/h3-4,6,8-10,16,18H,5,7H2,1-2H3;(H,3,4)(H,5,6)

Composition: C (59.99%), H (5.59%), N (7.77%), O (26.64%)

Molar Mass: 360.366

Atom Count: 46

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	360.132136372
Formal Charge	0
FSP3	0.28
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	FABUSQFFBYHBHX-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	77.67
Topological Polar Surface Area	43.38
Polarizability	30.3
Ring Count	3
Rotatable Bond Count	4

Suppliers

ChemBridge Corp.

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<4 Days	1609402-93-8		$152.95-$1,933.15$152.95$379.50$1,933.15