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Home > Boronic Acids > 1356111-39-1
1356111-39-1 | 1-(4-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)cyclohex-3-en-1-yl)pyrrolidine
CAS No: 1356111-39-1 Catalog No: AG009WJ8 MDL No:MFCD20257866
Product Description
Catalog Number:
AG009WJ8
Chemical Name:
1-(4-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)cyclohex-3-en-1-yl)pyrrolidine
CAS Number:
1356111-39-1
Molecular Formula:
C16H28BNO2
Molecular Weight:
277.2100
MDL Number:
MFCD20257866
IUPAC Name:
1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)cyclohex-3-en-1-yl]pyrrolidine
InChI:
InChI=1S/C16H28BNO2/c1-15(2)16(3,4)20-17(19-15)13-7-9-14(10-8-13)18-11-5-6-12-18/h7,14H,5-6,8-12H2,1-4H3
InChI Key:
WHPQAACYAYSKKW-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)C1=CCC(CC1)N1CCCC1
Properties
Complexity:
383
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.221g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.215g/mol
Monoisotopic Mass:
277.221g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
21.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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