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885687-81-0 | 5-Bromo-8-(bromomethyl)-2-methoxyquinoline
CAS No: 885687-81-0 Catalog No: AG004DMM MDL No:MFCD21603866
Product Description
Catalog Number:
AG004DMM
Chemical Name:
5-Bromo-8-(bromomethyl)-2-methoxyquinoline
CAS Number:
885687-81-0
Molecular Formula:
C11H9Br2NO
Molecular Weight:
331.0033
MDL Number:
MFCD21603866
IUPAC Name:
5-bromo-8-(bromomethyl)-2-methoxyquinoline
InChI:
InChI=1S/C11H9Br2NO/c1-15-10-5-3-8-9(13)4-2-7(6-12)11(8)14-10/h2-5H,6H2,1H3
InChI Key:
OOPHPPJUKMZRRQ-UHFFFAOYSA-N
SMILES:
COc1ccc2c(n1)c(CBr)ccc2Br
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.903g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
331.007g/mol
Monoisotopic Mass:
328.905g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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