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180-94-9 | PIPERIDONE-4-PROPYLENKETAL
CAS No: 180-94-9 Catalog No: AG0021KG MDL No:MFCD00040749
Product Description
Catalog Number:
AG0021KG
Chemical Name:
PIPERIDONE-4-PROPYLENKETAL
CAS Number:
180-94-9
Molecular Formula:
C8H15NO2
Molecular Weight:
157.2102
MDL Number:
MFCD00040749
IUPAC Name:
1,5-dioxa-9-azaspiro[5.5]undecane
InChI:
InChI=1S/C8H15NO2/c1-6-10-8(11-7-1)2-4-9-5-3-8/h9H,1-7H2
InChI Key:
ZQGLEEFGEZLSAJ-UHFFFAOYSA-N
SMILES:
N1CCC2(CC1)OCCCO2
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.11g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
157.213g/mol
Monoisotopic Mass:
157.11g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
30.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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