N,N-bis(2-chloroethyl)-4-[(3-nitrophenyl)diazenyl]aniline
Basic information
- CAS
66710-75-6- Standard SMILES
O=[N+]([O-])c1cccc(N=Nc2ccc(N(CCCl)CCCl)cc2)c1- InChIKey
KAZWRDYCPFFMGD-UHFFFAOYSA-N- Molecular formula
- C16H16Cl2N4O2
- Average molar mass
- 367.2 g/mol
- Monoisotopic mass
- 366.0650312
Names & identifiers
- Preferred name
- N,N-bis(2-chloroethyl)-4-[(3-nitrophenyl)diazenyl]aniline
- IUPAC
- N,N-bis(2-chloroethyl)-4-[(3-nitrophenyl)diazenyl]aniline
Names & synonyms
66710-75-6N,N-bis(2-chloroethyl)-4-[(3-nitrophenyl)diazenyl]anilineNSC260463DTXSID70312667NSC-260463DS-006643N,N-Bis(2-chloroethyl)-4-[(E)-(3-nitrophenyl)diazenyl]anilineBENZENAMINE,N,N-BIS(2-CHLOROETHYL)-4-[2-(3-NITROPHENYL)DIAZENYL]-
Database identifiers
- CAS
66710-75-6- PubChem CID
- 319014
- DTXSID
DTXSID70312667
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 73.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 405
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Compound notes
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