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Home > Boronic Acids > 1447709-01-4
1447709-01-4 | Boronic acid, B-benzo[b]naphtho[1,2-d]thien-5-yl-
CAS No: 1447709-01-4 Catalog No: AG001K4T MDL No:
Product Description
Catalog Number:
AG001K4T
Chemical Name:
Boronic acid, B-benzo[b]naphtho[1,2-d]thien-5-yl-
CAS Number:
1447709-01-4
Molecular Formula:
C16H11BO2S
Molecular Weight:
278.1333
IUPAC Name:
naphtho[2,1-b][1]benzothiol-5-ylboronic acid
InChI:
InChI=1S/C16H11BO2S/c18-17(19)13-9-15-16(11-6-2-1-5-10(11)13)12-7-3-4-8-14(12)20-15/h1-9,18-19H
InChI Key:
GDSIVKCZCZDTPN-UHFFFAOYSA-N
SMILES:
OB(c1cc2sc3c(c2c2c1cccc2)cccc3)O
Properties
Complexity:
364
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.057g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
278.132g/mol
Monoisotopic Mass:
278.057g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
68.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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