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Home > Other Heterocycles > 1707367-86-9
1707367-86-9 | 2-Isopropyl-1,3,8-triazaspiro[4.5]dec-1-en-4-one hydrochloride
CAS No: 1707367-86-9 Catalog No: AG01F6AO MDL No:
Product Description
Catalog Number:
AG01F6AO
Chemical Name:
2-Isopropyl-1,3,8-triazaspiro[4.5]dec-1-en-4-one hydrochloride
CAS Number:
1707367-86-9
Molecular Formula:
C10H18ClN3O
Molecular Weight:
231.7224
IUPAC Name:
2-propan-2-yl-1,3,8-triazaspiro[4.5]dec-1-en-4-one;hydrochloride
InChI:
InChI=1S/C10H17N3O.ClH/c1-7(2)8-12-9(14)10(13-8)3-5-11-6-4-10;/h7,11H,3-6H2,1-2H3,(H,12,13,14);1H
InChI Key:
NGVDNTLYXYWQKJ-UHFFFAOYSA-N
SMILES:
CC(C1=NC2(C(=O)N1)CCNCC2)C.Cl
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.114g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
231.724g/mol
Monoisotopic Mass:
231.114g/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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