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Home > Boronic Acids > 1256358-91-4
1256358-91-4 | 1H-Indole, 5-chloro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS No: 1256358-91-4 Catalog No: AG000O6C MDL No:MFCD11858358
Product Description
Catalog Number:
AG000O6C
Chemical Name:
1H-Indole, 5-chloro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS Number:
1256358-91-4
Molecular Formula:
C14H17BClNO2
Molecular Weight:
277.5543
MDL Number:
MFCD11858358
IUPAC Name:
5-chloro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole
InChI:
InChI=1S/C14H17BClNO2/c1-13(2)14(3,4)19-15(18-13)12-8-9-7-10(16)5-6-11(9)17-12/h5-8,17H,1-4H3
InChI Key:
BILMSGOXKJBFGK-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)cc([nH]2)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
347
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.104g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
277.555g/mol
Monoisotopic Mass:
277.104g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
34.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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