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4,5-Diazatetracyclo[7.4.0.02,4.03,8]trideca-1(13),5,9,11-tetraene

HCID 337516
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Basic information

CAS
73834-11-4
Standard SMILES
C1=NN2C3c4ccccc4C(C1)C32
InChIKey
ISQRPZVSIDXDHK-UHFFFAOYSA-N
Molecular formula
C11H10N2
Average molar mass
170.21 g/mol
Monoisotopic mass
170.08439833

Names & identifiers

Preferred name
4,5-Diazatetracyclo[7.4.0.02,4.03,8]trideca-1(13),5,9,11-tetraene
IUPAC
4,5-diazatetracyclo[7.4.0.02,4.03,8]trideca-1(13),5,9,11-tetraene

Names & synonyms

NSC35592973834-11-4DTXSID40320178NSC-3559291,3b,7b,7c-Tetrahydro-3,3a-diazacyclopropa[jk]fluorene

Database identifiers

CAS
73834-11-4
PubChem CID
337516
DTXSID
DTXSID40320178

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
15.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
0
Heavy atoms
13
Formal charge
0
Complexity
273

Related reactions

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Compound notes

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