200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 29045-94-1
29045-94-1 | Benzoic acid, 4-[[2-(2,4-dinitrophenyl)hydrazinylidene]methyl]-, methyl ester
CAS No: 29045-94-1 Catalog No: AG002VBU MDL No:
Product Description
Catalog Number:
AG002VBU
Chemical Name:
Benzoic acid, 4-[[2-(2,4-dinitrophenyl)hydrazinylidene]methyl]-, methyl ester
CAS Number:
29045-94-1
Molecular Formula:
C15H12N4O6
Molecular Weight:
344.2790
IUPAC Name:
methyl 4-[[(2,4-dinitrophenyl)hydrazinylidene]methyl]benzoate
InChI:
InChI=1S/C15H12N4O6/c1-25-15(20)11-4-2-10(3-5-11)9-16-17-13-7-6-12(18(21)22)8-14(13)19(23)24/h2-9,17H,1H3
InChI Key:
IEGGPIDDZREPLN-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(cc1)C=NNc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
521
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.076g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
344.283g/mol
Monoisotopic Mass:
344.076g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
142A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.