CAS 91270-68-7 | 6-Bromo-1-hydroxynaphthalene | CAS Number 91270-68-7

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91270-68-7 | 6-Bromo-1-hydroxynaphthalene

CAS No: 91270-68-7 Catalog No: AG0039NV MDL No:MFCD15528811

Product Description

Catalog Number:

AG0039NV

Chemical Name:

6-Bromo-1-hydroxynaphthalene

CAS Number:

91270-68-7

Molecular Formula:

C10H7BrO

Molecular Weight:

223.0660

MDL Number:

MFCD15528811

IUPAC Name:

6-bromonaphthalen-1-ol

InChI:

InChI=1S/C10H7BrO/c11-8-4-5-9-7(6-8)2-1-3-10(9)12/h1-6,12H

InChI Key:

FSUYQOYAPVYVHS-UHFFFAOYSA-N

SMILES:

Brc1ccc2c(c1)cccc2O

Properties

Complexity:

160

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

221.968g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

223.069g/mol

Monoisotopic Mass:

221.968g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

20.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.4

Literature

Title	Journal
Synthesis and antibacterial activity of pentacyclines: a novel class of tetracycline analogs.	Journal of medicinal chemistry 20110609
7-Bromo-1-(4-chloro-phenyl-sulfan-yl)-2-phenyl-naphtho[2,1-b]furan.	Acta crystallographica. Section E, Structure reports online 20100101