200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 89188-70-5
89188-70-5 | 2-Pentenal, 4-nitro-5-phenyl-4-(phenylmethyl)-, (Z)-
CAS No: 89188-70-5 Catalog No: AG004TOQ MDL No:
Product Description
Catalog Number:
AG004TOQ
Chemical Name:
2-Pentenal, 4-nitro-5-phenyl-4-(phenylmethyl)-, (Z)-
CAS Number:
89188-70-5
Molecular Formula:
C18H17NO3
Molecular Weight:
295.3325
IUPAC Name:
4-benzyl-4-nitro-5-phenylpent-2-enal
InChI:
InChI=1S/C18H17NO3/c20-13-7-12-18(19(21)22,14-16-8-3-1-4-9-16)15-17-10-5-2-6-11-17/h1-13H,14-15H2
InChI Key:
DDGXTRSEPQEKRJ-UHFFFAOYSA-N
SMILES:
O=C/C=C\C([N+](=O)[O-])(Cc1ccccc1)Cc1ccccc1
Properties
Complexity:
368
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:
6
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.