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N-(1,1-Dimethylethyl)-4-nitrobenzenamine

HCID 20095
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
4138-38-9
Standard SMILES
CC(C)(C)Nc1ccc([N+](=O)[O-])cc1
InChIKey
UTMISJPMGAMQPR-UHFFFAOYSA-N
Molecular formula
C10H14N2O2
Average molar mass
194.23 g/mol
Monoisotopic mass
194.10552769

Names & identifiers

Preferred name
N-(1,1-Dimethylethyl)-4-nitrobenzenamine
IUPAC
N-tert-butyl-4-nitroaniline
English name
N-(1,1-Dimethylethyl)-4-nitrobenzenamine
Molecular weight
0

Names & synonyms

4138-38-9N-(1,1-DIMETHYLETHYL)-4-NITROBENZENAMINEDTXSID10194323RefChem:359790DTXCID20116814N-tert-butyl-4-nitroanilineN-(tert-Butyl)-4-nitroanilineN-t-butyl-p-nitroanilineSCHEMBL1466162UTMISJPMGAMQPR-UHFFFAOYSA-Ntert-butyl-(4-nitro-phenyl)-amineDB-321290
Show more names
1-[tert-Butylamino]-4-nitrobenzene

Database identifiers

CAS
4138-38-9
PubChem CID
20095
DTXSID
DTXSID10194323
Nikkaji
J356.282D

Properties

Computed structural properties

XLogP
3
Topological polar surface area
57.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
14
Formal charge
0
Complexity
197

Chemistry & industry

Suppliers1 total

北京海特乐思克科技有限公司15210893940; 15116916250 · [email protected]

Related reactions

20 records
New reaction record
HRID 468320 reaction equation
HRID 468320As productuspto-grants-2014_01
HRID 468321 reaction equation
HRID 468321As reactantuspto-grants-2014_01
HRID 503314 reaction equation
HRID 503314As productuspto-grants-2010_08
HRID 503315 reaction equation
HRID 503315As reactantuspto-grants-2010_08
HRID 799219 reaction equation
HRID 799219As productTest data from https://doi.org/10.1039/C8SC04228D
HRID 1403891 reaction equation
HRID 1403891As productuspto-grants-2014_12
HRID 1403892 reaction equation
HRID 1403892As reactantuspto-grants-2014_12
HRID 1542519 reaction equation
HRID 1542519As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
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Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes