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1032758-80-7 | 3-Nitro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl);pyridin-2-amine
CAS No: 1032758-80-7 Catalog No: AG003JSR MDL No:MFCD11867866
Product Description
Catalog Number:
AG003JSR
Chemical Name:
3-Nitro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl);pyridin-2-amine
CAS Number:
1032758-80-7
Molecular Formula:
C11H16BN3O4
Molecular Weight:
265.0734
MDL Number:
MFCD11867866
IUPAC Name:
3-nitro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine
InChI:
InChI=1S/C11H16BN3O4/c1-10(2)11(3,4)19-12(18-10)7-5-8(15(16)17)9(13)14-6-7/h5-6H,1-4H3,(H2,13,14)
InChI Key:
HXMCKJVPNJJZTO-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(cnc1N)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
355
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.123g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
265.076g/mol
Monoisotopic Mass:
265.123g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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