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673488-75-0 | 3-Borabicyclo[3.3.1]non-6-ene, 3-methoxy-7-(1-methoxyethyl)-
CAS No: 673488-75-0 Catalog No: AG005OZ3 MDL No:
Product Description
Catalog Number:
AG005OZ3
Chemical Name:
3-Borabicyclo[3.3.1]non-6-ene, 3-methoxy-7-(1-methoxyethyl)-
CAS Number:
673488-75-0
Molecular Formula:
C12H21BO2
Molecular Weight:
208.1049
IUPAC Name:
3-methoxy-7-(1-methoxyethyl)-3-borabicyclo[3.3.1]non-6-ene
InChI:
InChI=1S/C12H21BO2/c1-9(14-2)12-5-10-4-11(6-12)8-13(7-10)15-3/h5,9-11H,4,6-8H2,1-3H3
InChI Key:
FIFCRROGUQKUAB-UHFFFAOYSA-N
SMILES:
COB1CC2CC(C1)C=C(C2)C(OC)C
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.163g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.108g/mol
Monoisotopic Mass:
208.163g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
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