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883231-20-7 | (6-((tert-Butoxycarbonyl);amino);pyridin-3-yl);boronic acid
CAS No: 883231-20-7 Catalog No: AG003MZS MDL No:MFCD11975411
Product Description
Catalog Number:
AG003MZS
Chemical Name:
(6-((tert-Butoxycarbonyl);amino);pyridin-3-yl);boronic acid
CAS Number:
883231-20-7
Molecular Formula:
C10H15BN2O4
Molecular Weight:
238.0481
MDL Number:
MFCD11975411
IUPAC Name:
[6-[(2-methylpropan-2-yl)oxycarbonylamino]pyridin-3-yl]boronic acid
InChI:
InChI=1S/C10H15BN2O4/c1-10(2,3)17-9(14)13-8-5-4-7(6-12-8)11(15)16/h4-6,15-16H,1-3H3,(H,12,13,14)
InChI Key:
KAFAFKANQAGBRH-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1ccc(cn1)B(O)O
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.112g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
238.05g/mol
Monoisotopic Mass:
238.112g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
91.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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