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(2R,3R,4S,5R,6R)-2-[(6-bromonaphthalen-2-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

(2R,3R,4S,5R,6R)-2-[(6-bromonaphthalen-2-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

CAS: 25997-59-5

Formula: C16H17BrO6

SMILES: OC[C@H]1O[C@H](OC2=CC3=CC=C(Br)C=C3C=C2)[C@H](O)[C@@H](O)[C@H]1O

IUPAC: (2R,3R,4S,5R,6R)-2-[(6-bromonaphthalen-2-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

InChI: InChI=1S/C16H17BrO6/c17-10-3-1-9-6-11(4-2-8(9)5-10)22-16-15(21)14(20)13(19)12(7-18)23-16/h1-6,12-16,18-21H,7H2/t12-,13-,14+,15-,16+/m1/s1

Composition: C (49.89%), H (4.45%), Br (20.74%), O (24.92%)

Molar Mass: 385.21

Atom Count: 40

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 5
Exact Mass 384.020851
Formal Charge 0
FSP3 0.37
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 4
InChIKey NLRXQZJJCPRATR-CWVYHPPDSA-N
Lipinski's Rule of Five 1
Molar Refractivity 84.26
Topological Polar Surface Area 99.38
Polarizability 34.85
Ring Count 3
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
98% <6 Days 25997-59-5 $552.00-$2,349.45$552.00$920.00$2,349.45
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