Benzaldehyde,p-[bis(2-chloroethyl)amino]-, 1,4-phthalazinediyldihydrazone (8ci)
Basic information
- CAS
27818-66-2- Standard SMILES
ClCCN(CCCl)c1ccc(C=NNc2nnc(NN=Cc3ccc(N(CCCl)CCCl)cc3)c3ccccc23)cc1- InChIKey
CAMLFZBPGVUOEP-UHFFFAOYSA-N- Molecular formula
- C30H32Cl4N8
- Average molar mass
- 646.4 g/mol
- Monoisotopic mass
- 644.150404
Names & identifiers
- Preferred name
- Benzaldehyde,p-[bis(2-chloroethyl)amino]-, 1,4-phthalazinediyldihydrazone (8ci)
- IUPAC
- 1-N,4-N-bis[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]phthalazine-1,4-diamine
Names & synonyms
27818-66-2DTXSID00950495DS-006492Benzaldehyde,p-[bis(2-chloroethyl)amino]-, 1,4-phthalazinediyldihydrazone (8ci)4,4'-[2,3-Dihydrophthalazine-1,4-diylidenebis(hydrazine-2,1-diylidenemethanylylidene)]bis[N,N-bis(2-chloroethyl)aniline]4,4'-{2,3-Dihydrophthalazine-1,4-diylidenebis[(hydrazine-2,1-diylidene)methanylylidene]}bis[N,N-bis(2-chloroethyl)aniline]
Database identifiers
- CAS
27818-66-2- PubChem CID
- 266355
- DTXSID
DTXSID00950495
Properties
Computed structural properties
- XLogP
- 7.6
- Topological polar surface area
- 81 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 16
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 715
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Related reactions
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Compound notes
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