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Home > Boronic Acids > 238088-16-9
238088-16-9 | 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)butanenitrile
CAS No: 238088-16-9 Catalog No: AG003JBV MDL No:MFCD09953480
Product Description
Catalog Number:
AG003JBV
Chemical Name:
4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)butanenitrile
CAS Number:
238088-16-9
Molecular Formula:
C10H18BNO2
Molecular Weight:
195.0664
MDL Number:
MFCD09953480
IUPAC Name:
4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)butanenitrile
InChI:
InChI=1S/C10H18BNO2/c1-9(2)10(3,4)14-11(13-9)7-5-6-8-12/h5-7H2,1-4H3
InChI Key:
LVMSRWXPZLRTIC-UHFFFAOYSA-N
SMILES:
N#CCCCB1OC(C(O1)(C)C)(C)C
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.143g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.069g/mol
Monoisotopic Mass:
195.143g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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