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Home > Bromides > 1289386-69-1
1289386-69-1 | 3-Azetidinecarboxylic acid, 1-(6-bromo-2-pyridinyl)-
CAS No: 1289386-69-1 Catalog No: AG000YLW MDL No:MFCD18837442
Product Description
Catalog Number:
AG000YLW
Chemical Name:
3-Azetidinecarboxylic acid, 1-(6-bromo-2-pyridinyl)-
CAS Number:
1289386-69-1
Molecular Formula:
C9H9BrN2O2
Molecular Weight:
257.0840
MDL Number:
MFCD18837442
IUPAC Name:
1-(6-bromopyridin-2-yl)azetidine-3-carboxylic acid
InChI:
InChI=1S/C9H9BrN2O2/c10-7-2-1-3-8(11-7)12-4-6(5-12)9(13)14/h1-3,6H,4-5H2,(H,13,14)
InChI Key:
ZPLNUHDGBKVSEH-UHFFFAOYSA-N
SMILES:
OC(=O)C1CN(C1)c1cccc(n1)Br
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.985g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
257.087g/mol
Monoisotopic Mass:
255.985g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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