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79404-70-9

79404-70-9 | 1,4-Dioxa-8-azaspiro[4.5]decane, 8-(1-oxo-2-propenyl)-

CAS No: 79404-70-9 Catalog No: AG00520W MDL No:

Product Description

Catalog Number:
AG00520W
Chemical Name:
1,4-Dioxa-8-azaspiro[4.5]decane, 8-(1-oxo-2-propenyl)-
CAS Number:
79404-70-9
Molecular Formula:
C10H15NO3
Molecular Weight:
197.2310
IUPAC Name:
1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)prop-2-en-1-one
InChI:
InChI=1S/C10H15NO3/c1-2-9(12)11-5-3-10(4-6-11)13-7-8-14-10/h2H,1,3-8H2
InChI Key:
UDCTUXCXMQODNP-UHFFFAOYSA-N
SMILES:
C=CC(=O)N1CCC2(CC1)OCCO2

Properties

Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.105g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.234g/mol
Monoisotopic Mass:
197.105g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  

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