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9-Acridinamine, N-(2-((2-chloroethyl)thio)ethyl)-, hydrochloride

HCID 38134
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Basic information

CAS
38914-98-6
Standard SMILES
ClCCSCC[NH2+]c1c2ccccc2nc2ccccc12.[Cl-]
InChIKey
BLSKFJGPURAJCV-UHFFFAOYSA-N
Molecular formula
C17H18Cl2N2S
Average molar mass
353.3 g/mol
Monoisotopic mass
352.0567751

Names & identifiers

Preferred name
9-Acridinamine, N-(2-((2-chloroethyl)thio)ethyl)-, hydrochloride
IUPAC
acridin-9-yl-[2-(2-chloroethylsulfanyl)ethyl]azanium chloride

Names & synonyms

ICR 31638914-98-69-((2-((2-Chloroethyl)thio)ethyl)amino)acridine hydrochlorideAcridine, 9-((2-((2-chloroethyl)thio)ethyl)amino)-, hydrochloride9-ACRIDINAMINE, N-(2-((2-CHLOROETHYL)THIO)ETHYL)-, HYDROCHLORIDERefChem:312925

Database identifiers

CAS
38914-98-6
PubChem CID
38134

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
293

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