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264881-47-2 | 1-Naphthalenol, 6-bromo-5,8-dimethoxy-
CAS No: 264881-47-2 Catalog No: AG002TER MDL No:
Product Description
Catalog Number:
AG002TER
Chemical Name:
1-Naphthalenol, 6-bromo-5,8-dimethoxy-
CAS Number:
264881-47-2
Molecular Formula:
C12H11BrO3
Molecular Weight:
283.1179
IUPAC Name:
6-bromo-5,8-dimethoxynaphthalen-1-ol
InChI:
InChI=1S/C12H11BrO3/c1-15-10-6-8(13)12(16-2)7-4-3-5-9(14)11(7)10/h3-6,14H,1-2H3
InChI Key:
OKHFXWQMVQAXPJ-UHFFFAOYSA-N
SMILES:
COc1c(Br)cc(c2c1cccc2O)OC
Properties
Complexity:
236
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.989g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
283.121g/mol
Monoisotopic Mass:
281.989g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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