2-[(5-bromo-1H-indol-3-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

2-[(5-bromo-1H-indol-3-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

CAS: 97753-82-7

Formula: C14H16BrNO6

SMILES: OCC1OC(OC2=CNC3=CC=C(Br)C=C23)C(O)C(O)C1O

IUPAC: 2-[(5-bromo-1H-indol-3-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

InChI: InChI=1/C14H16BrNO6/c15-6-1-2-8-7(3-6)9(4-16-8)21-14-13(20)12(19)11(18)10(5-17)22-14/h1-4,10-14,16-20H,5H2

Composition: C (44.94%), H (4.31%), Br (21.35%), N (3.74%), O (25.65%)

Molar Mass: 374.187

Atom Count: 38

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	5
Exact Mass	373.0161
Formal Charge	0
FSP3	0.43
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	5
InChIKey	LINMATFDVHBYOS-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	78.89
Topological Polar Surface Area	115.17
Polarizability	32.65
Ring Count	3
Rotatable Bond Count	3

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Purity	LeadTime	CAS		UnitPrice
98%	<14 Days	97753-82-7		Quote Only