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1,4-Diisopropyl-6-methyl-1,2,3,4-tetrahydroquinoxaline

HCID 22041393
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
329217-77-8
Standard SMILES
Cc1ccc2c(c1)N(C(C)C)CCN2C(C)C
InChIKey
AYYUMOFZWGBHKI-UHFFFAOYSA-N
Molecular formula
C15H24N2
Average molar mass
232.36 g/mol
Monoisotopic mass
232.19394877

Names & identifiers

Preferred name
1,4-Diisopropyl-6-methyl-1,2,3,4-tetrahydroquinoxaline
IUPAC
6-methyl-1,4-di(propan-2-yl)-2,3-dihydroquinoxaline

Names & synonyms

SCHEMBL5486042SCHEMBL54944801,4-diisopropyl-6-methyl-1,2,3,4-tetrahydroquinoxalineAYYUMOFZWGBHKI-UHFFFAOYSA-NDTXSID701181658329217-77-86-Methyl-1,4-di(propan-2-yl)-1,2,3,4-tetrahydroquinoxaline1,2,3,4-Tetrahydro-6-methyl-1,4-bis(1-methylethyl)quinoxaline

Database identifiers

CAS
329217-77-8
PubChem CID
22041393
DTXSID
DTXSID701181658

Properties

Computed structural propertiesFilling in

XLogP
3.9
Topological polar surface area
6.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
17
Formal charge
0
Complexity
249

Related reactions

5 records
New reaction record
HRID 183161 reaction equation
HRID 183161As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 488818 reaction equation
HRID 488818As reactantuspto-grants-2005_12
HRID 1057836 reaction equation
HRID 1057836As reactantuspto-grants-2003_02
HRID 1765412 reaction equation
HRID 1765412As reactantuspto-grants-2007_06
HRID 1884487 reaction equation
HRID 1884487As reactantuspto-grants-2004_07

Compound notes

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