4-(Bis(2-chloroethyl)amino)benzaldehyde oxime
Basic information
- CAS
18237-77-9- Standard SMILES
ON=Cc1ccc(N(CCCl)CCCl)cc1- InChIKey
FXVFBBQKGSWGPW-UHFFFAOYSA-N- Molecular formula
- C11H14Cl2N2O
- Average molar mass
- 261.14 g/mol
- Monoisotopic mass
- 260.0483185
Names & identifiers
- Preferred name
- 4-(Bis(2-chloroethyl)amino)benzaldehyde oxime
- IUPAC
- N-[[4-[bis(2-chloroethyl)amino]phenyl]methylidene]hydroxylamine
Names & synonyms
18237-77-9TAV7J3TQT34-(Bis(2-chloroethyl)amino)benzaldehyde oximeBenzaldehyde, p-(bis(2-chloroethyl)amino)-, oximeUNII-TAV7J3TQT3NSC-240387NSC 240387DTXSID20939580p-(BIS(2-CHLOROETHYL)AMINO)BENZALDEHYDE OXIMEBENZALDEHYDE, 4-(BIS(2-CHLOROETHYL)AMINO)-, OXIMEN-({4-[Bis(2-chloroethyl)amino]phenyl}methylidene)hydroxylamine
Database identifiers
- CAS
18237-77-9- PubChem CID
- 99853
- DTXSID
DTXSID20939580- UNII
- TAV7J3TQT3
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 35.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 200
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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