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99875-26-0 | 1-ACETYLOCTAHYDRO-AZOCINE
CAS No: 99875-26-0 Catalog No: AG003W3M MDL No:MFCD08714732
Product Description
Catalog Number:
AG003W3M
Chemical Name:
1-ACETYLOCTAHYDRO-AZOCINE
CAS Number:
99875-26-0
Molecular Formula:
C9H17NO
Molecular Weight:
155.2374
MDL Number:
MFCD08714732
IUPAC Name:
1-(azocan-1-yl)ethanone
InChI:
InChI=1S/C9H17NO/c1-9(11)10-7-5-3-2-4-6-8-10/h2-8H2,1H3
InChI Key:
TZFKYUXRORVYQV-UHFFFAOYSA-N
SMILES:
CC(=O)N1CCCCCCC1
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.131g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
155.241g/mol
Monoisotopic Mass:
155.131g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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