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Home > Other Heterocycles > 1713163-91-7
1713163-91-7 | 2-Ethyl-1,3,8-triazaspiro[4.5]dec-1-en-4-one hydrochloride
CAS No: 1713163-91-7 Catalog No: AG01F74L MDL No:
Product Description
Catalog Number:
AG01F74L
Chemical Name:
2-Ethyl-1,3,8-triazaspiro[4.5]dec-1-en-4-one hydrochloride
CAS Number:
1713163-91-7
Molecular Formula:
C9H16ClN3O
Molecular Weight:
217.6958
IUPAC Name:
2-ethyl-1,3,8-triazaspiro[4.5]dec-1-en-4-one;hydrochloride
InChI:
InChI=1S/C9H15N3O.ClH/c1-2-7-11-8(13)9(12-7)3-5-10-6-4-9;/h10H,2-6H2,1H3,(H,11,12,13);1H
InChI Key:
CYSBWTLRTOVQGF-UHFFFAOYSA-N
SMILES:
CCC1=NC2(C(=O)N1)CCNCC2.Cl
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.098g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
217.697g/mol
Monoisotopic Mass:
217.098g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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