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Home > Boronic Acids > 1312479-75-6
1312479-75-6 | 2-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-5,6-dihydropyridin-1(2H)-yl)pyrimidine
CAS No: 1312479-75-6 Catalog No: AG00HSEJ MDL No:MFCD22415486
Product Description
Catalog Number:
AG00HSEJ
Chemical Name:
2-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-5,6-dihydropyridin-1(2H)-yl)pyrimidine
CAS Number:
1312479-75-6
Molecular Formula:
C15H22BN3O2
Molecular Weight:
287.1651
MDL Number:
MFCD22415486
IUPAC Name:
2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridin-1-yl]pyrimidine
InChI:
InChI=1S/C15H22BN3O2/c1-14(2)15(3,4)21-16(20-14)12-6-10-19(11-7-12)13-17-8-5-9-18-13/h5-6,8-9H,7,10-11H2,1-4H3
InChI Key:
GQGCRMSNGVANQA-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)C1=CCN(CC1)c1ncccn1
Properties
Complexity:
403
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.181g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.17g/mol
Monoisotopic Mass:
287.181g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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