200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 84041-65-6
84041-65-6 | 2-Propenoic acid,1-(2-nitrophenyl)ethyl ester
CAS No: 84041-65-6 Catalog No: AG004Q5E MDL No:
Product Description
Catalog Number:
AG004Q5E
Chemical Name:
2-Propenoic acid,1-(2-nitrophenyl)ethyl ester
CAS Number:
84041-65-6
Molecular Formula:
C11H11NO4
Molecular Weight:
221.2093
IUPAC Name:
1-(2-nitrophenyl)ethyl prop-2-enoate
InChI:
InChI=1S/C11H11NO4/c1-3-11(13)16-8(2)9-6-4-5-7-10(9)12(14)15/h3-8H,1H2,2H3
InChI Key:
RNYPOUOIGJXNMU-UHFFFAOYSA-N
SMILES:
C=CC(=O)OC(c1ccccc1[N+](=O)[O-])C
EC Number:
281-845-4
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.069g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.212g/mol
Monoisotopic Mass:
221.069g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.