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83710-62-7 | Naphthalene,1-bromo-6-methoxy-
CAS No: 83710-62-7 Catalog No: AG004XPR MDL No:
Product Description
Catalog Number:
AG004XPR
Chemical Name:
Naphthalene,1-bromo-6-methoxy-
CAS Number:
83710-62-7
Molecular Formula:
C11H9BrO
Molecular Weight:
237.0926
IUPAC Name:
1-bromo-6-methoxynaphthalene
InChI:
InChI=1S/C11H9BrO/c1-13-9-5-6-10-8(7-9)3-2-4-11(10)12/h2-7H,1H3
InChI Key:
YWYUBKSTSJQFQI-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)cccc2Br
NSC Number:
148963
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.984g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.096g/mol
Monoisotopic Mass:
235.984g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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