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Home > Nitro Compounds > 1782-03-2
1782-03-2 | Cyclooctene, 1-nitro-
CAS No: 1782-03-2 Catalog No: AG0025U8 MDL No:
Product Description
Catalog Number:
AG0025U8
Chemical Name:
Cyclooctene, 1-nitro-
CAS Number:
1782-03-2
Molecular Formula:
C8H13NO2
Molecular Weight:
155.1943
IUPAC Name:
1-nitrocyclooctene
InChI:
InChI=1S/C8H13NO2/c10-9(11)8-6-4-2-1-3-5-7-8/h6H,1-5,7H2
InChI Key:
LNMRSKLLRKNZGP-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)C1=CCCCCCC1
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.095g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
155.197g/mol
Monoisotopic Mass:
155.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.9
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