200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1289387-13-8
1289387-13-8 | 3-Azetidinecarboxylic acid, 1-(5-fluoro-2-pyrimidinyl)-
CAS No: 1289387-13-8 Catalog No: AG000YN0 MDL No:MFCD18837436
Product Description
Catalog Number:
AG000YN0
Chemical Name:
3-Azetidinecarboxylic acid, 1-(5-fluoro-2-pyrimidinyl)-
CAS Number:
1289387-13-8
Molecular Formula:
C8H8FN3O2
Molecular Weight:
197.1664
MDL Number:
MFCD18837436
IUPAC Name:
1-(5-fluoropyrimidin-2-yl)azetidine-3-carboxylic acid
InChI:
InChI=1S/C8H8FN3O2/c9-6-1-10-8(11-2-6)12-3-5(4-12)7(13)14/h1-2,5H,3-4H2,(H,13,14)
InChI Key:
CWWQJGFDOQLIQC-UHFFFAOYSA-N
SMILES:
OC(=O)C1CN(C1)c1ncc(cn1)F
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.06g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
197.169g/mol
Monoisotopic Mass:
197.06g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
66.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.