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274-07-7 | 1,3,2-Benzodioxaborole
CAS No: 274-07-7 Catalog No: AG00IKIV MDL No:MFCD00005846
Product Description
Catalog Number:
AG00IKIV
Chemical Name:
1,3,2-Benzodioxaborole
CAS Number:
274-07-7
Molecular Formula:
C6H5BO2
Molecular Weight:
119.9137
MDL Number:
MFCD00005846
InChI:
InChI=1S/C6H4BO2/c1-2-4-6-5(3-1)8-7-9-6/h1-4H
InChI Key:
ZDQWVKDDJDIVAL-UHFFFAOYSA-N
SMILES:
B1Oc2c(O1)cccc2
EC Number:
205-991-5
Properties
Complexity:
95.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
119.03g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
118.906g/mol
Monoisotopic Mass:
119.03g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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