200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 89706-91-2
89706-91-2 | Cyclopentanone, 3-(3,3-dimethoxy-1-nitropropyl)-2-pentyl-
CAS No: 89706-91-2 Catalog No: AG0042OP MDL No:
Product Description
Catalog Number:
AG0042OP
Chemical Name:
Cyclopentanone, 3-(3,3-dimethoxy-1-nitropropyl)-2-pentyl-
CAS Number:
89706-91-2
Molecular Formula:
C15H27NO5
Molecular Weight:
301.3786
IUPAC Name:
3-(3,3-dimethoxy-1-nitropropyl)-2-pentylcyclopentan-1-one
InChI:
InChI=1S/C15H27NO5/c1-4-5-6-7-12-11(8-9-14(12)17)13(16(18)19)10-15(20-2)21-3/h11-13,15H,4-10H2,1-3H3
InChI Key:
JOGGLIKPQMTCGI-UHFFFAOYSA-N
SMILES:
CCCCCC1C(=O)CCC1C([N+](=O)[O-])CC(OC)OC
Properties
Complexity:
337
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.189g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
301.383g/mol
Monoisotopic Mass:
301.189g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
81.4A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.