200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1855889-83-6
1855889-83-6 | 2-(3-ethoxy-4-nitro-1H-pyrazol-1-yl)acetic acid
CAS No: 1855889-83-6 Catalog No: AG01FJ54 MDL No:
Product Description
Catalog Number:
AG01FJ54
Chemical Name:
2-(3-ethoxy-4-nitro-1H-pyrazol-1-yl)acetic acid
CAS Number:
1855889-83-6
Molecular Formula:
C7H9N3O5
Molecular Weight:
215.1635
IUPAC Name:
2-(3-ethoxy-4-nitropyrazol-1-yl)acetic acid
InChI:
InChI=1S/C7H9N3O5/c1-2-15-7-5(10(13)14)3-9(8-7)4-6(11)12/h3H,2,4H2,1H3,(H,11,12)
InChI Key:
ARMICJZRVTWWSU-UHFFFAOYSA-N
SMILES:
CCOc1nn(cc1[N+](=O)[O-])CC(=O)O
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.054g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
215.165g/mol
Monoisotopic Mass:
215.054g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.