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23537-80-6 | 1,4-Methanonaphthalene, 1-bromo-1,4-dihydro-
CAS No: 23537-80-6 Catalog No: AG002NM5 MDL No:
Product Description
Catalog Number:
AG002NM5
Chemical Name:
1,4-Methanonaphthalene, 1-bromo-1,4-dihydro-
CAS Number:
23537-80-6
Molecular Formula:
C11H9Br
Molecular Weight:
221.0932
IUPAC Name:
1-bromotricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraene
InChI:
InChI=1S/C11H9Br/c12-11-6-5-8(7-11)9-3-1-2-4-10(9)11/h1-6,8H,7H2
InChI Key:
WWCIEGRATKCRJN-UHFFFAOYSA-N
SMILES:
BrC12C=CC(C1)c1c2cccc1
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.989g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.097g/mol
Monoisotopic Mass:
219.989g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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