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943145-62-8

943145-62-8 | 2-Phenyl-1,3,8-triazaspiro[4.5]dec-1-en-4-one hydrochloride

CAS No: 943145-62-8 Catalog No: AG01EZH8 MDL No:

Product Description

Catalog Number:
AG01EZH8
Chemical Name:
2-Phenyl-1,3,8-triazaspiro[4.5]dec-1-en-4-one hydrochloride
CAS Number:
943145-62-8
Molecular Formula:
C13H16ClN3O
Molecular Weight:
265.7386
IUPAC Name:
2-phenyl-1,3,8-triazaspiro[4.5]dec-1-en-4-one;hydrochloride
InChI:
InChI=1S/C13H15N3O.ClH/c17-12-13(6-8-14-9-7-13)16-11(15-12)10-4-2-1-3-5-10;/h1-5,14H,6-9H2,(H,15,16,17);1H
InChI Key:
HTHBUNVSYXXCAE-UHFFFAOYSA-N
SMILES:
O=C1NC(=NC21CCNCC2)c1ccccc1.Cl

Properties

Complexity:
339  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.098g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
265.741g/mol
Monoisotopic Mass:
265.098g/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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