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Home > Other Heterocycles > 2059947-16-7
2059947-16-7 | 8-(1H-pyrazol-3-yl)-6-azaspiro[3.4]octane
CAS No: 2059947-16-7 Catalog No: AG01BYPN MDL No:MFCD30487272
Product Description
Catalog Number:
AG01BYPN
Chemical Name:
8-(1H-pyrazol-3-yl)-6-azaspiro[3.4]octane
CAS Number:
2059947-16-7
Molecular Formula:
C10H15N3
Molecular Weight:
177.2462
MDL Number:
MFCD30487272
IUPAC Name:
8-(1H-pyrazol-5-yl)-6-azaspiro[3.4]octane
InChI:
InChI=1S/C10H15N3/c1-3-10(4-1)7-11-6-8(10)9-2-5-12-13-9/h2,5,8,11H,1,3-4,6-7H2,(H,12,13)
InChI Key:
WVMOTOWFRZAXKF-UHFFFAOYSA-N
SMILES:
C1CC2(C1)CNCC2c1n[nH]cc1
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.127g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
177.251g/mol
Monoisotopic Mass:
177.127g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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