9-Acridinamine, 1,2,3,4-tetrahydro-N-(2-((2-chloroethyl)thio)ethyl)-, hydrochloride
Basic information
- CAS
38915-03-6- Standard SMILES
ClCCSCC[NH2+]c1c2c(nc3ccccc13)CCCC2.[Cl-]- InChIKey
NJHNIQIOYCYHTH-UHFFFAOYSA-N- Molecular formula
- C17H22Cl2N2S
- Average molar mass
- 357.3 g/mol
- Monoisotopic mass
- 356.0880753
Names & identifiers
- Preferred name
- 9-Acridinamine, 1,2,3,4-tetrahydro-N-(2-((2-chloroethyl)thio)ethyl)-, hydrochloride
- IUPAC
- 2-(2-chloroethylsulfanyl)ethyl-(1,2,3,4-tetrahydroacridin-9-yl)azanium chloride
Names & synonyms
ICR 33838915-03-61,2,3,4-Tetrahydro-9-((2-((2-chloroethyl)thio)ethyl)amino)acridine hydrochloride9-Acridinamine, 1,2,3,4-tetrahydro-N-(2-((2-chloroethyl)thio)ethyl)-, hydrochlorideAcridine, 1,2,3,4-tetrahydro-9-((2-((2-chloroethyl)thio)ethyl)amino)-, hydrochlorideRefChem:312909
Database identifiers
- CAS
38915-03-6- PubChem CID
- 38138
Properties
Computed structural properties
- Topological polar surface area
- 54.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 315
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Compound notes
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