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748812-61-5

748812-61-5 | tert-Butyl (5-bromo-3-methylpyridin-2-yl);carbamate

CAS No: 748812-61-5 Catalog No: AG005GM9 MDL No:MFCD11109816

Product Description

Catalog Number:
AG005GM9
Chemical Name:
tert-Butyl (5-bromo-3-methylpyridin-2-yl);carbamate
CAS Number:
748812-61-5
Molecular Formula:
C11H15BrN2O2
Molecular Weight:
287.1530
MDL Number:
MFCD11109816
IUPAC Name:
tert-butyl N-(5-bromo-3-methylpyridin-2-yl)carbamate
InChI:
InChI=1S/C11H15BrN2O2/c1-7-5-8(12)6-13-9(7)14-10(15)16-11(2,3)4/h5-6H,1-4H3,(H,13,14,15)
InChI Key:
PMFVIRYXHAMNRY-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1ncc(cc1C)Br

Properties

Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.032g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
287.157g/mol
Monoisotopic Mass:
286.032g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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