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3-Hydrazinyl-5,6-dihydro-8-methoxybenzo[h]cinnoline

HCID 9991968
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Basic information

CAS
107127-49-1
Standard SMILES
COc1ccc2c(c1)CCc1cc(NN)nnc1-2
InChIKey
OBWKYBRVIVXAFI-UHFFFAOYSA-N
Molecular formula
C13H14N4O
Average molar mass
242.28 g/mol
Monoisotopic mass
242.11676108

Names & identifiers

Preferred name
3-Hydrazinyl-5,6-dihydro-8-methoxybenzo[h]cinnoline
IUPAC
(8-methoxy-5,6-dihydrobenzo[h]cinnolin-3-yl)hydrazine

Names & synonyms

DTXSID201223302AKOS012080389107127-49-13-Hydrazinyl-5,6-dihydro-8-methoxybenzo[h]cinnoline3-Hydrazinylidene-8-methoxy-2,3,5,6-tetrahydrobenzo[h]cinnoline

Database identifiers

CAS
107127-49-1
PubChem CID
9991968
DTXSID
DTXSID201223302
Nikkaji
J516.009J

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
73.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
18
Formal charge
0
Complexity
288

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