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Isoquinoline, 1,2,3,4-tetrahydro-2-cyclopropyl-, hydrochloride

HCID 59341
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Basic information

CAS
102395-77-7
Standard SMILES
[Cl-].c1ccc2c(c1)CC[NH+](C1CC1)C2
InChIKey
PMYZSAYZMPTCML-UHFFFAOYSA-N
Molecular formula
C12H16ClN
Average molar mass
209.71 g/mol
Monoisotopic mass
209.0971272

Names & identifiers

Preferred name
Isoquinoline, 1,2,3,4-tetrahydro-2-cyclopropyl-, hydrochloride
IUPAC
2-cyclopropyl-1,2,3,4-tetrahydroisoquinolin-2-ium chloride
English name
2-cyclopropyl-3,4-dihydro-1H-isoquinoline chloride
Molecular formula
C12H16ClN
Molecular weight
209.72

Names & synonyms

102395-77-7ISOQUINOLINE, 1,2,3,4-TETRAHYDRO-2-CYCLOPROPYL-, HYDROCHLORIDERefChem:1087727N-Cyclopropyl-1,2,3,4-tetrahydroisoquinoline hydrochloride2-cyclopropyl-1,2,3,4-tetrahydroisoquinolin-2-ium;chloride2-cyclopropyl-3,4-dihydro-1H-isoquinoline chloride

Database identifiers

CAS
102395-77-7
PubChem CID
59341

Properties

Computed structural properties

Topological polar surface area
4.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
14
Formal charge
0
Complexity
186

Chemistry & industry

Suppliers2 total

HONEST JOY HOLDINGS LIMITED[email protected]
CHEMICAL LAND21[email protected]

Related reactions

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Compound notes

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