Home Amines 1083057-14-0
1083057-14-0,MFCD16659611
Catalog No.:AA003I2Y
1083057-14-0 | tert-Butyl 3-(6-amino-3-methylpyridin-2-yl)benzoate
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Technical Information
Catalog Number:
AA003I2Y
Chemical Name:
tert-Butyl 3-(6-amino-3-methylpyridin-2-yl)benzoate
CAS Number:
1083057-14-0
Molecular Formula:
C17H20N2O2
Molecular Weight:
284.3529
MDL Number:
MFCD16659611
IUPAC Name:
tert-butyl 3-(6-amino-3-methylpyridin-2-yl)benzoate
InChI:
InChI=1S/C17H20N2O2/c1-11-8-9-14(18)19-15(11)12-6-5-7-13(10-12)16(20)21-17(2,3)4/h5-10H,1-4H3,(H2,18,19)
InChI Key:
RZGNTHQZYZRDDB-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(n1)c1cccc(c1)C(=O)OC(C)(C)C)C
EC Number:
800-303-5
Properties
Computed Properties
 
Complexity:
364  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.152g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
284.359g/mol
Monoisotopic Mass:
284.152g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
65.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  

Synonyms
 
1083057-14-0 
tert-Butyl 3-(6-amino-3-methylpyridin-2-yl)benzoate 
BCP14027 
CS-M2542 
ANW-69289 
MFCD16659611 
ZINC64033450 
AKOS016005759 
Benzoic acid, 3-(6-amino-3-methyl-2-pyridinyl)-, 1,1-dimethylethyl ester 
MP-2025 
SB18038 
KS-000002B6 
3-(6-Amino-3-methylpyridin-2-yl)benzoic acid tert-butyl ester 
DS-12054 
EN002682 
AB0068638 
AX8160249 
TC-158034 
4CH-008539 
ST24031746 
Z3873 
tert-butyl-3-(6-amino-3-methylpyridin-2-yl)benzoate 
2-Methyl-2-propanyl 3-(6-amino-3-methyl-2-pyridinyl)benzoate 
3-(6-Amino-3-methyl-pyridin-2-yl)-benzoicacidtert-butylester 
C17H20N2O2 
EC 800-303-5 
tert-Butyl3-(6-amino-3-methylpyridin-2-yl)benzoate 
3-(6-Amino-3-methyl-pyridin-2-yl)-benzoic acid tert-butyl ester 
AK-32812 
RZGNTHQZYZRDDB-UHFFFAOYSA-N 
SCHEMBL725997 
CTK8C2914 
DTXSID00670429 
Literature
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