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Home > Boronic Acids > 1073353-81-7
1073353-81-7 | 2-(4-Methoxy-2-nitrophenyl);-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS No: 1073353-81-7 Catalog No: AG003LMG MDL No:MFCD10699701
Product Description
Catalog Number:
AG003LMG
Chemical Name:
2-(4-Methoxy-2-nitrophenyl);-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS Number:
1073353-81-7
Molecular Formula:
C13H18BNO5
Molecular Weight:
279.0967
MDL Number:
MFCD10699701
IUPAC Name:
2-(4-methoxy-2-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C13H18BNO5/c1-12(2)13(3,4)20-14(19-12)10-7-6-9(18-5)8-11(10)15(16)17/h6-8H,1-5H3
InChI Key:
KVPUEHWNHSWGSJ-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)[N+](=O)[O-])B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
365
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.128g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.099g/mol
Monoisotopic Mass:
279.128g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
73.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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