Carbazole, 1,2,3,4-tetrahydro-6-chloro-9-(3-dimethylaminopropyl)-, oxalate
Basic information
- CAS
41734-62-7- Standard SMILES
C[NH+](C)CCCn1c2c(c3cc(Cl)ccc31)CCCC2.O=C([O-])C(=O)O- InChIKey
XSXRETGHZYFDKF-UHFFFAOYSA-N- Molecular formula
- C19H25ClN2O4
- Average molar mass
- 380.9 g/mol
- Monoisotopic mass
- 380.150285
Names & identifiers
- Preferred name
- Carbazole, 1,2,3,4-tetrahydro-6-chloro-9-(3-dimethylaminopropyl)-, oxalate
- IUPAC
- 3-(6-chloro-1,2,3,4-tetrahydrocarbazol-9-yl)propyl-dimethylazanium;2-hydroxy-2-oxoacetate
Names & synonyms
41734-62-7CARBAZOLE, 1,2,3,4-TETRAHYDRO-6-CHLORO-9-(3-DIMETHYLAMINOPROPYL)-, OXALATE1,2,3,4-Tetrahydro-6-chloro-9-(3-dimethylaminopropyl)carbazole oxalateDTXSID201945369H-Carbazol-9-propanamine, 1,2,3,4-tetrahydro-6-chloro-N,N-dimethyl-, oxalatePropylamine, N,N-dimethyl-3-(1,2,3,4-tetrahydro-6-chlorocarbazol-9-yl)-, oxalateRefChem:333244DTXCID601170273-(6-Chloro-1,2,3,4-tetrahydro-9H-carbazol-9-yl)-N,N-dimethylpropan-1-aminium hydrogen ethanedioate
Database identifiers
- CAS
41734-62-7- PubChem CID
- 38965
- DTXSID
DTXSID20194536
Properties
Computed structural properties
- Topological polar surface area
- 86.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 398
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Compound notes
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