Acetamide, N-(5-(bis(2-(acetyloxy)ethyl)amino)-2-(2-(2-methoxy-4-nitrophenyl)diazenyl)phenyl)-
Basic information
- CAS
1533-77-3- Standard SMILES
COc1cc([N+](=O)[O-])ccc1N=Nc1ccc(N(CCOC(C)=O)CCOC(C)=O)cc1NC(C)=O- InChIKey
ZQZWTTNVCIXDOF-UHFFFAOYSA-N- Molecular formula
- C23H27N5O8
- Average molar mass
- 501.5 g/mol
- Monoisotopic mass
- 501.18596284
Names & identifiers
- Preferred name
- Acetamide, N-(5-(bis(2-(acetyloxy)ethyl)amino)-2-(2-(2-methoxy-4-nitrophenyl)diazenyl)phenyl)-
- IUPAC
- 2-[3-acetamido-N-(2-acetyloxyethyl)-4-[(2-methoxy-4-nitrophenyl)diazenyl]anilino]ethyl acetate
- English name
- 2,2'-[[3-carbamoyl-4-[(2-methoxy-4-nitrophenyl)azo]phenyl]imino]diethyl diacetate
- Molecular formula
- C23H27N5O8
- Molecular weight
- 501.49
Names & synonyms
EINECS 216-250-0Acetamide, N-[5-[bis[2-(acetyloxy)ethyl]amino]-2-[(2-methoxy-4-nitrophenyl)azo]phenyl]-Acetamide, N-(5-(bis(2-(acetyloxy)ethyl)amino)-2-((2-methoxy-4-nitrophenyl)azo)phenyl)-Acetamide, N-(5-(bis(2-(acetyloxy)ethyl)amino)-2-(2-(2-methoxy-4-nitrophenyl)diazenyl)phenyl)-Acetamide, N-[5-[bis[2-(acetyloxy)ethyl]amino]-2-[2-(2-methoxy-4-nitrophenyl)diazenyl]phenyl]-RefChem:5517551533-77-32,2'-[[3-Carbamoyl-4-[(2-methoxy-4-nitrophenyl)azo]phenyl]imino]diethyl diacetateAcetanilide, 5'-(bis(2-hydroxyethyl)amino)-2'-((2-methoxy-4-nitrophenyl)azo)-, diacetate (ester)2,2'-((3-Carbamoyl-4-((2-methoxy-4-nitrophenyl)azo)phenyl)imino)diethyl diacetateZQZWTTNVCIXDOF-UHFFFAOYSA-N2-[3-acetamido-N-(2-acetyloxyethyl)-4-[(2-methoxy-4-nitrophenyl)diazenyl]anilino]ethyl acetate
Show more names
N-[5-[Bis[2-(acetyloxy)ethyl]amino]-2-[(2-methoxy-4-nitrophenyl)azo]phenyl]acetamideAcetanilide,5'-[bis(2-hydroxyethyl)amino]-2'-[(2-methoxy-4-nitrophenyl)azo]-,diacetate(ester)
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 165 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 13
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 769
Physicochemical properties
- Melting point
- 170 · 170-176 °C
- Boiling point
- 710.12 · 710.120±60.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.308 · 1.308±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 14.191 · 14.191±0.70(predicted)
- EPA Substance Registry System
- 5 · Acetamide, N-[5-[bis[2-(acetyloxy)ethyl]amino]-2-[(2-methoxy-4-nitrophenyl)azo]phenyl]- (1533-77-3)
- 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 InformationAcetamide, N-[5-[bis[2-(acetyloxy)ethyl]amino]-2-[2-(2-methoxy-4-nitrophenyl)diazenyl]phenyl]-: ACTIVE
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Compound notes
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