200,000+ products from a single source!
sales@angenechem.com
Home > Other Heterocycles > 2060046-72-0
2060046-72-0 | 8-(1,4-dimethyl-1H-pyrazol-5-yl)-6-azaspiro[3.4]octan-5-one
CAS No: 2060046-72-0 Catalog No: AG01BZUD MDL No:MFCD30486855
Product Description
Catalog Number:
AG01BZUD
Chemical Name:
8-(1,4-dimethyl-1H-pyrazol-5-yl)-6-azaspiro[3.4]octan-5-one
CAS Number:
2060046-72-0
Molecular Formula:
C12H17N3O
Molecular Weight:
219.2829
MDL Number:
MFCD30486855
IUPAC Name:
8-(2,4-dimethylpyrazol-3-yl)-6-azaspiro[3.4]octan-5-one
InChI:
InChI=1S/C12H17N3O/c1-8-6-14-15(2)10(8)9-7-13-11(16)12(9)4-3-5-12/h6,9H,3-5,7H2,1-2H3,(H,13,16)
InChI Key:
UQVLQVDZMDRGAN-UHFFFAOYSA-N
SMILES:
O=C1NCC(C21CCC2)c1c(C)cnn1C
Properties
Complexity:
313
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.137g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
219.288g/mol
Monoisotopic Mass:
219.137g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.