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Home > Nitro Compounds > 6690-51-3
6690-51-3 | 4-(2',4'-DINITROPHENYLAZO)-PHENOL
CAS No: 6690-51-3 Catalog No: AG00FE1T MDL No:
Product Description
Catalog Number:
AG00FE1T
Chemical Name:
4-(2',4'-DINITROPHENYLAZO)-PHENOL
CAS Number:
6690-51-3
Molecular Formula:
C12H8N4O5
Molecular Weight:
288.2157
IUPAC Name:
4-[(2,4-dinitrophenyl)diazenyl]phenol
InChI:
InChI=1S/C12H8N4O5/c17-10-4-1-8(2-5-10)13-14-11-6-3-9(15(18)19)7-12(11)16(20)21/h1-7,17H
InChI Key:
SQAYGJNMLDVSHZ-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)/N=N/c1ccc(cc1N(=O)=O)N(=O)=O
NSC Number:
77054
Properties
Complexity:
411
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.049g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
288.219g/mol
Monoisotopic Mass:
288.049g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
137A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Literature
| Title | Journal |
|---|---|
| A colorimetric chiral sensor based on chiral crown ether for the recognition of the two enantiomers of primary amino alcohols and amines. | Chirality 20110401 |
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