200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 89718-62-7
89718-62-7 | 1(2H)-Naphthalenone, 3,4-dihydro-2-(2-nitro-1-phenylethyl)-
CAS No: 89718-62-7 Catalog No: AG0043VR MDL No:
Product Description
Catalog Number:
AG0043VR
Chemical Name:
1(2H)-Naphthalenone, 3,4-dihydro-2-(2-nitro-1-phenylethyl)-
CAS Number:
89718-62-7
Molecular Formula:
C18H17NO3
Molecular Weight:
295.3325
IUPAC Name:
2-(2-nitro-1-phenylethyl)-3,4-dihydro-2H-naphthalen-1-one
InChI:
InChI=1S/C18H17NO3/c20-18-15-9-5-4-8-14(15)10-11-16(18)17(12-19(21)22)13-6-2-1-3-7-13/h1-9,16-17H,10-12H2
InChI Key:
VFZFVEDCOZWQDQ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)CC(C1CCc2c(C1=O)cccc2)c1ccccc1
Properties
Complexity:
411
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.121g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.338g/mol
Monoisotopic Mass:
295.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.