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164062-48-0 | Azacycloheptadec-9-ene
CAS No: 164062-48-0 Catalog No: AG001UL9 MDL No:
Product Description
Catalog Number:
AG001UL9
Chemical Name:
Azacycloheptadec-9-ene
CAS Number:
164062-48-0
Molecular Formula:
C16H31N
Molecular Weight:
237.4240
IUPAC Name:
1-azacycloheptadec-9-ene
InChI:
InChI=1S/C16H31N/c1-2-4-6-8-10-12-14-16-17-15-13-11-9-7-5-3-1/h1-2,17H,3-16H2
InChI Key:
RZZQBVWWFNXAME-UHFFFAOYSA-N
SMILES:
C1CCNCCCCCCCC=CCCCC1
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.246g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
237.431g/mol
Monoisotopic Mass:
237.246g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
5.6
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