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166111-51-9 | Naphthalene, 4-bromo-1,2,3,5,6,7-hexahydro-
CAS No: 166111-51-9 Catalog No: AG001WHX MDL No:
Product Description
Catalog Number:
AG001WHX
Chemical Name:
Naphthalene, 4-bromo-1,2,3,5,6,7-hexahydro-
CAS Number:
166111-51-9
Molecular Formula:
C10H13Br
Molecular Weight:
213.1142
IUPAC Name:
4-bromo-1,2,3,5,6,7-hexahydronaphthalene
InChI:
InChI=1S/C10H13Br/c11-10-7-3-5-8-4-1-2-6-9(8)10/h4H,1-3,5-7H2
InChI Key:
ZLLFUVXMVBKMGG-UHFFFAOYSA-N
SMILES:
BrC1=C2CCCC=C2CCC1
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.02g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
213.118g/mol
Monoisotopic Mass:
212.02g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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