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Home > Other Heterocycles > 79010-90-5
79010-90-5 | 7-Borabicyclo[4.1.0]hepta-2,4-diene
CAS No: 79010-90-5 Catalog No: AG005NS9 MDL No:
Product Description
Catalog Number:
AG005NS9
Chemical Name:
7-Borabicyclo[4.1.0]hepta-2,4-diene
CAS Number:
79010-90-5
Molecular Formula:
C6H7B
Molecular Weight:
89.9308
IUPAC Name:
7λ2-borabicyclo[4.1.0]hepta-2,4-diene
InChI:
InChI=1S/C6H6B/c1-2-4-6-5(3-1)7-6/h1-6H
InChI Key:
COKYNTPGEBIDKS-UHFFFAOYSA-N
SMILES:
C1=CC2C(C=C1)B2
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
89.056g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
88.924g/mol
Monoisotopic Mass:
89.056g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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