1, 1,4-Bis(2-chloroethyl)-, dibromide
Basic information
- CAS
79235-06-6- Standard SMILES
ClCC[N+]12CC[N+](CCCl)(CC1)C2.[Br-]- InChIKey
HAHHMNRRNQSPEI-UHFFFAOYSA-M- Molecular formula
- C9H18BrCl2N2+
- Average molar mass
- 305.06 g/mol
- Monoisotopic mass
- 303.00304
Names & identifiers
- Preferred name
- 1, 1,4-Bis(2-chloroethyl)-, dibromide
- IUPAC
- 1,4-bis(2-chloroethyl)-1,4-diazoniabicyclo[2.2.1]heptane bromide
Names & synonyms
79235-06-61,4-bis(2-chloroethyl)-1,4-diazoniabicyclo[2.2.1]heptane1, 1,4-bis(2-chloroethyl)-, dibromideNSC328788NSC-328788DS-000346
Database identifiers
- CAS
79235-06-6- PubChem CID
- 54599296
Properties
Computed structural properties
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 1
- Complexity
- 168
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Related reactions
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Compound notes
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