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208336-47-4 | 9-Borabicyclo[3.3.1]nonane, 9-(4-bromobutyl)-
CAS No: 208336-47-4 Catalog No: AG002JN5 MDL No:
Product Description
Catalog Number:
AG002JN5
Chemical Name:
9-Borabicyclo[3.3.1]nonane, 9-(4-bromobutyl)-
CAS Number:
208336-47-4
Molecular Formula:
C12H22BBr
Molecular Weight:
257.0181
IUPAC Name:
9-(4-bromobutyl)-9-borabicyclo[3.3.1]nonane
InChI:
InChI=1S/C12H22BBr/c14-10-2-1-9-13-11-5-3-6-12(13)8-4-7-11/h11-12H,1-10H2
InChI Key:
INYXTNKKWDMRSL-UHFFFAOYSA-N
SMILES:
BrCCCCB1C2CCCC1CCC2
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.1g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.022g/mol
Monoisotopic Mass:
256.1g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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