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197151-49-8 | 7-Octenenitrile, 6-methylene-
CAS No: 197151-49-8 Catalog No: AG002AM1 MDL No:
Product Description
Catalog Number:
AG002AM1
Chemical Name:
7-Octenenitrile, 6-methylene-
CAS Number:
197151-49-8
Molecular Formula:
C9H13N
Molecular Weight:
135.2062
IUPAC Name:
6-methylideneoct-7-enenitrile
InChI:
InChI=1S/C9H13N/c1-3-9(2)7-5-4-6-8-10/h3H,1-2,4-7H2
InChI Key:
YNBQLTQWZNDJQN-UHFFFAOYSA-N
SMILES:
N#CCCCCC(=C)C=C
Properties
Complexity:
159
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.105g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
135.21g/mol
Monoisotopic Mass:
135.105g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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