Home Amines 1018680-09-5
1018680-09-5,MFCD12964565
Catalog No.:AA0005Q2
1018680-09-5 | 3-Dimethylaminopyridine-5-boronic acid
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Technical Information
Catalog Number:
AA0005Q2
Chemical Name:
3-Dimethylaminopyridine-5-boronic acid
CAS Number:
1018680-09-5
Molecular Formula:
C7H11BN2O2
Molecular Weight:
165.9854
MDL Number:
MFCD12964565
IUPAC Name:
[5-(dimethylamino)pyridin-3-yl]boronic acid
InChI:
InChI=1S/C7H11BN2O2/c1-10(2)7-3-6(8(11)12)4-9-5-7/h3-5,11-12H,1-2H3
InChI Key:
XONOLKVBZTVRBK-UHFFFAOYSA-N
SMILES:
OB(c1cncc(c1)N(C)C)O
Properties
Computed Properties
 
Complexity:
143  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.091g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
165.987g/mol
Monoisotopic Mass:
166.091g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
56.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
1018680-09-5 
(5-(Dimethylamino)pyridin-3-yl)boronic acid 
CD-157 
MFCD12964565 
AKOS016014141 
ZINC169747781 
5-Dimethylaminopyridine-3-boronic acid 
CS-W006409 
FCH1153084 
RL00097 
AX8164479 
DB-058719 
5-(dimethylamino)pyridin-3-ylboronic acid 
4CH-000183 
FT-0715758 
ST24034779 
A-9230 
J-516340 
5-(Dimethylamino)-3-pyridinylboronic acid, AldrichCPR 
(5-(Dimethylamino)pyridin-3-yl)boronicacid 
3-Dimethylaminopyridine-5-boronic acid 
AK129567 
[5-(Dimethylamino)pyridin-3-yl]boronic acid 
5-(Dimethylamino)pyridine-3-boronic acid 
B-[5-(dimethylamino)-3-pyridinyl]-Boronic acid 
DTXSID00725463 
KS-00000I5S 
Literature
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