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Home > Boronic Acids > 480425-37-4
480425-37-4 | N-[3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL]FORMAMIDE
CAS No: 480425-37-4 Catalog No: AG00D9RC MDL No:MFCD03789265
Product Description
Catalog Number:
AG00D9RC
Chemical Name:
N-[3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL]FORMAMIDE
CAS Number:
480425-37-4
Molecular Formula:
C13H18BNO3
Molecular Weight:
247.0979
MDL Number:
MFCD03789265
IUPAC Name:
N-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]formamide
InChI:
InChI=1S/C13H18BNO3/c1-12(2)13(3,4)18-14(17-12)10-6-5-7-11(8-10)15-9-16/h5-9H,1-4H3,(H,15,16)
InChI Key:
NYDQNRBQQQKVKY-UHFFFAOYSA-N
SMILES:
O=CNc1cccc(c1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
303
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.138g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
247.101g/mol
Monoisotopic Mass:
247.138g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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