CAS
939759-05-4 Purity
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939759-05-4 Purity
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1-(4-Fluoro-benzyl)-1,2,3,4-tetrahydro-quinoxaline dihydrochloride
CAS
939760-20-0
Catalog Number
ACM939760200
Category
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What is the molecular formula of 1-(4-Fluoro-benzyl)-1,2,3,4-tetrahydro-quinoxaline dihydrochloride?
The molecular formula is C15H17Cl2FN2.
What is the molecular weight of 1-(4-Fluoro-benzyl)-1,2,3,4-tetrahydro-quinoxaline dihydrochloride?
The molecular weight is 315.2 g/mol.
What is the IUPAC name of 1-(4-Fluoro-benzyl)-1,2,3,4-tetrahydro-quinoxaline dihydrochloride?
The IUPAC name is 4-[(4-fluorophenyl)methyl]-2,3-dihydro-1H-quinoxaline;dihydrochloride.
What is the InChI of 1-(4-Fluoro-benzyl)-1,2,3,4-tetrahydro-quinoxaline dihydrochloride?
The InChI is InChI=1S/C15H15FN2.2ClH/c16-13-7-5-12(6-8-13)11-18-10-9-17-14-3-1-2-4-15(14)18;;/h1-8,17H,9-11H2;2*1H.
What is the InChIKey of 1-(4-Fluoro-benzyl)-1,2,3,4-tetrahydro-quinoxaline dihydrochloride?
The InChIKey is QPEAEQHWEUSQKT-UHFFFAOYSA-N.
What is the canonical SMILES representation of 1-(4-Fluoro-benzyl)-1,2,3,4-tetrahydro-quinoxaline dihydrochloride?
The canonical SMILES representation is C1CN(C2=CC=CC=C2N1)CC3=CC=C(C=C3)F.Cl.Cl.
What is the hydrogen bond donor count of 1-(4-Fluoro-benzyl)-1,2,3,4-tetrahydro-quinoxaline dihydrochloride?
The hydrogen bond donor count is 3.
What is the hydrogen bond acceptor count of 1-(4-Fluoro-benzyl)-1,2,3,4-tetrahydro-quinoxaline dihydrochloride?
The hydrogen bond acceptor count is 3.
What is the rotatable bond count of 1-(4-Fluoro-benzyl)-1,2,3,4-tetrahydro-quinoxaline dihydrochloride?
The rotatable bond count is 2.
Is 1-(4-Fluoro-benzyl)-1,2,3,4-tetrahydro-quinoxaline dihydrochloride a canonicalized compound?
Yes, it is a canonicalized compound.
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