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Home > Boronic Acids > 1357387-28-0
1357387-28-0 | N-(Prop-2-yn-1-yl)-3-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide
CAS No: 1357387-28-0 Catalog No: AG00AAVD MDL No:MFCD20275029
Product Description
Catalog Number:
AG00AAVD
Chemical Name:
N-(Prop-2-yn-1-yl)-3-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide
CAS Number:
1357387-28-0
Molecular Formula:
C16H20BNO3
Molecular Weight:
285.1459
MDL Number:
MFCD20275029
IUPAC Name:
N-prop-2-ynyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide
InChI:
InChI=1S/C16H20BNO3/c1-6-10-18-14(19)12-8-7-9-13(11-12)17-20-15(2,3)16(4,5)21-17/h1,7-9,11H,10H2,2-5H3,(H,18,19)
InChI Key:
BJJVNRNPHMBKSF-UHFFFAOYSA-N
SMILES:
C#CCNC(=O)c1cccc(c1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
436
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.154g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
285.15g/mol
Monoisotopic Mass:
285.154g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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