Basic information
- CAS
68413-42-3- Standard SMILES
CC(=O)OCCN(CCOC(C)=O)c1ccc(N=Nc2ccc([N+](=O)[O-])cc2Cl)c(C)c1- InChIKey
BDAQFSJXVZDVGC-UHFFFAOYSA-N- Molecular formula
- C21H23ClN4O6
- Average molar mass
- 462.9 g/mol
- Monoisotopic mass
- 462.1306122
Names & identifiers
- Preferred name
- Ethanol, 2,2'-((4-(2-(2-chloro-4-nitrophenyl)diazenyl)-3-methylphenyl)imino)bis-, 1,1'-diacetate
- IUPAC
- 2-[N-(2-acetyloxyethyl)-4-[(2-chloro-4-nitrophenyl)diazenyl]-3-methylanilino]ethyl acetate
- English name
- 2,2'-[[4-[(2-chloro-4-nitrophenyl)azo]-3-methylphenyl]imino]bisethyl diacetate
- Molecular formula
- C21H23ClN4O6
- Molecular weight
- 462.88
Names & synonyms
68413-42-3EINECS 270-217-5Aniline, 4-(2-chloro-4-nitrophenylazo)-3-methyl-N,N-di-beta-acetoxyethyl-Ethanol, 2,2'-((4-(2-(2-chloro-4-nitrophenyl)diazenyl)-3-methylphenyl)imino)bis-, 1,1'-diacetateEthanol, 2,2'-[[4-[2-(2-chloro-4-nitrophenyl)diazenyl]-3-methylphenyl]imino]bis-, 1,1'-diacetateRefChem:1382272,2'-((4-((2-Chloro-4-nitrophenyl)azo)-3-methylphenyl)imino)bisethyl diacetateEthanol, 2,2'-((4-((2-chloro-4-nitrophenyl)azo)-3-methylphenyl)imino)bis-, diacetate (ester)Ethanol, 2,2'-[[4-[(2-chloro-4-nitrophenyl)azo]-3-methylphenyl]imino]bis-, diacetate (ester)2,2'-[[4-[(2-chloro-4-nitrophenyl)azo]-3-methylphenyl]imino]bisethyl diacetate3LR9TJ7ACTDTXSID8071512
Show more names
2,2'-[[4-[(2-Chloro-4-nitrophenyl)azo]-3-methylphenyl]imino]bisethanol diacetate2-[N-(2-acetyloxyethyl)-4-[(2-chloro-4-nitrophenyl)diazenyl]-3-methylanilino]ethyl acetate
BDAQFSJXVZDVGC-UHFFFAOYSA-NNS00036588Ethanol, 2,2'-[4-(2-chloro-4-nitrophenylazo)-m-tolylimino]di-, diacetate2-[N-(2-acetyloxyethyl)-4-[(2-chloro-4-nitrophenyl)diazenyl]-3-methylanilino]ethylacetate({4-[(2-Chloro-4-nitrophenyl)diazenyl]-3-methylphenyl}azanediyl)di(ethane-2,1-diyl) diacetate
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 126 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 11
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 653
Physicochemical properties
- EPA Substance Registry System
- 2 · Ethanol, 2,2'-[[4-[(2-chloro-4-nitrophenyl)azo]-3-methylphenyl]imino]bis-, diacetate (ester) (68413-42-3)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationEthanol, 2,2'-[[4-[2-(2-chloro-4-nitrophenyl)diazenyl]-3-methylphenyl]imino]bis-, 1,1'-diacetate: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…