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Home > Boronic Acids > 683229-62-1
683229-62-1 | 5-METHOXY-1H-INDOLE-2-BORONIC ACID PINACOL ESTER
CAS No: 683229-62-1 Catalog No: AG00FFX5 MDL No:MFCD11858363
Product Description
Catalog Number:
AG00FFX5
Chemical Name:
5-METHOXY-1H-INDOLE-2-BORONIC ACID PINACOL ESTER
CAS Number:
683229-62-1
Molecular Formula:
C15H20BNO3
Molecular Weight:
273.1352
MDL Number:
MFCD11858363
IUPAC Name:
5-methoxy-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole
InChI:
InChI=1S/C15H20BNO3/c1-14(2)15(3,4)20-16(19-14)13-9-10-8-11(18-5)6-7-12(10)17-13/h6-9,17H,1-5H3
InChI Key:
AOZMEMXVPBBRNR-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)cc([nH]2)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.154g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
273.139g/mol
Monoisotopic Mass:
273.154g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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