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Home > Boronic Acids > 69448-21-1
69448-21-1 | 1,3,2-Benzothiazaborole, 2,3-dihydro-3-methyl-
CAS No: 69448-21-1 Catalog No: AG005M1B MDL No:
Product Description
Catalog Number:
AG005M1B
Chemical Name:
1,3,2-Benzothiazaborole, 2,3-dihydro-3-methyl-
CAS Number:
69448-21-1
Molecular Formula:
C7H8BNS
Molecular Weight:
149.0211
IUPAC Name:
3-methyl-1,3,2λ2-benzothiazaborole
InChI:
InChI=1S/C7H7BNS/c1-9-6-4-2-3-5-7(6)10-8-9/h2-5H,1H3
InChI Key:
WSUBCHVREISTFJ-UHFFFAOYSA-N
SMILES:
CN1BSc2c1cccc2
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.039g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.01g/mol
Monoisotopic Mass:
148.039g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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