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Home > Bromides > 1216703-32-0
1216703-32-0 | 6-(2-Aziridin-1-ylethoxy)-5-bromonicotinic acid
CAS No: 1216703-32-0 Catalog No: AG01F9QZ MDL No:
Product Description
Catalog Number:
AG01F9QZ
Chemical Name:
6-(2-Aziridin-1-ylethoxy)-5-bromonicotinic acid
CAS Number:
1216703-32-0
Molecular Formula:
C10H11BrN2O3
Molecular Weight:
287.1099
IUPAC Name:
6-[2-(aziridin-1-yl)ethoxy]-5-bromopyridine-3-carboxylic acid
InChI:
InChI=1S/C10H11BrN2O3/c11-8-5-7(10(14)15)6-12-9(8)16-4-3-13-1-2-13/h5-6H,1-4H2,(H,14,15)
InChI Key:
IXBRJAXTJLVAAR-UHFFFAOYSA-N
SMILES:
Brc1cc(cnc1OCCN1CC1)C(=O)O
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.995g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
287.113g/mol
Monoisotopic Mass:
285.995g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
62.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1
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