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Home > Other Heterocycles > 1023-85-4
1023-85-4 | 1,3,8-Triazaspiro[4.5]decan-4-one, 3-methyl-1-phenyl-, hydrochloride (1:1)
CAS No: 1023-85-4 Catalog No: AG00075T MDL No:
Product Description
Catalog Number:
AG00075T
Chemical Name:
1,3,8-Triazaspiro[4.5]decan-4-one, 3-methyl-1-phenyl-, hydrochloride (1:1)
CAS Number:
1023-85-4
Molecular Formula:
C14H20ClN3O
Molecular Weight:
281.7811
IUPAC Name:
3-methyl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one;hydrochloride
InChI:
InChI=1S/C14H19N3O.ClH/c1-16-11-17(12-5-3-2-4-6-12)14(13(16)18)7-9-15-10-8-14;/h2-6,15H,7-11H2,1H3;1H
InChI Key:
IFYWBEDKWLNJTM-UHFFFAOYSA-N
SMILES:
CN1CN(C2(C1=O)CCNCC2)c1ccccc1.Cl
EC Number:
213-825-8
NSC Number:
118101
Properties
Complexity:
319
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.129g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
281.784g/mol
Monoisotopic Mass:
281.129g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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