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Home > Boronic Acids > 893441-86-6
893441-86-6 | tert-Butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-1-carboxylate
CAS No: 893441-86-6 Catalog No: AG00IFMX MDL No:MFCD14155783
Product Description
Catalog Number:
AG00IFMX
Chemical Name:
tert-Butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-1-carboxylate
CAS Number:
893441-86-6
Molecular Formula:
C19H26BNO4
Molecular Weight:
343.2250
MDL Number:
MFCD14155783
IUPAC Name:
tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indole-1-carboxylate
InChI:
InChI=1S/C19H26BNO4/c1-17(2,3)23-16(22)21-12-11-13-14(9-8-10-15(13)21)20-24-18(4,5)19(6,7)25-20/h8-12H,1-7H3
InChI Key:
FUXWYWGKVFEKQX-UHFFFAOYSA-N
SMILES:
O=C(n1ccc2c1cccc2B1OC(C(O1)(C)C)(C)C)OC(C)(C)C
Properties
Complexity:
512
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
343.195g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
343.23g/mol
Monoisotopic Mass:
343.195g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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