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150367-10-5 | 1-Heptene, 1-nitro-, (1E)-
CAS No: 150367-10-5 Catalog No: AG001MK3 MDL No:
Product Description
Catalog Number:
AG001MK3
Chemical Name:
1-Heptene, 1-nitro-, (1E)-
CAS Number:
150367-10-5
Molecular Formula:
C7H13NO2
Molecular Weight:
143.1836
IUPAC Name:
1-nitrohept-1-ene
InChI:
InChI=1S/C7H13NO2/c1-2-3-4-5-6-7-8(9)10/h6-7H,2-5H2,1H3
InChI Key:
HESSXKKDBFQKFM-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)/C=C/CCCCC
Properties
Complexity:
115
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.095g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
143.186g/mol
Monoisotopic Mass:
143.095g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3
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