200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 66974-69-4
66974-69-4 | Benzoicacid, 2-(3,3-dimethyl-1-triazen-1-yl)-5-nitro-
CAS No: 66974-69-4 Catalog No: AG005RW9 MDL No:
Product Description
Catalog Number:
AG005RW9
Chemical Name:
Benzoicacid, 2-(3,3-dimethyl-1-triazen-1-yl)-5-nitro-
CAS Number:
66974-69-4
Molecular Formula:
C9H10N4O4
Molecular Weight:
238.2001
IUPAC Name:
2-(dimethylaminodiazenyl)-5-nitrobenzoic acid
InChI:
InChI=1S/C9H10N4O4/c1-12(2)11-10-8-4-3-6(13(16)17)5-7(8)9(14)15/h3-5H,1-2H3,(H,14,15)
InChI Key:
CWNMHHFBFOLRDS-UHFFFAOYSA-N
SMILES:
CN(N=Nc1ccc(cc1C(=O)O)[N+](=O)[O-])C
NSC Number:
233878
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.07g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
238.203g/mol
Monoisotopic Mass:
238.07g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.